NPASS Compound

Natural Product: NPC109083

Natural Product ID	NPC109083
Common Name ? The InCHIKey will be temporarily assigned as the "Common Name" if no IUPAC name or alternative short name is available.	Curcumin
IUPAC Name	(1E,4Z,6E)-5-hydroxy-1,7-bis(4-hydroxy-3-methoxyphenyl)hepta-1,4,6-trien-3-one
Synonyms	CI-75300; Curcumin; Diferuloylmethane; E100; Natural Yellow 3
Synthetic Gene Cluster	n.a.
ChEMBL Identifier	CHEMBL116438
PubChem CID	5281767
Chemical Classification	CHEMONTID:0000000 [Organic compounds] [CHEMONTID:0000261] Phenylpropanoids and polyketides [CHEMONTID:0002650] Diarylheptanoids [CHEMONTID:0002651] Linear diarylheptanoids [CHEMONTID:0000356] Curcuminoids

The Chemical Classification was calculated by Classyfire, a software for chemical taxonomy calculation. Reference: DOI:10.1186/s13321-016-0174-y.

Chemical Representations

RDKit 3D 47 48 0 0 0 0 0 0 0 0999 V2000 -6.7681 2.3462 0.9553 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4124 1.1789 0.4791 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6087 0.1294 0.0573 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2144 0.1947 0.0901 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4196 -0.8293 -0.3215 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9825 -0.7409 -0.2791 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3447 0.3126 0.1508 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 0.3066 0.1552 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1579 1.3235 0.5706 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2182 1.5878 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4305 2.8241 1.1862 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4569 0.9527 0.4322 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 -0.2099 -0.0377 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2162 -0.5818 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 -1.8605 -0.6991 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7735 -2.3072 -0.8744 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8280 -1.4801 -0.5343 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6045 -0.2265 -0.0271 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2832 0.1839 0.1332 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6824 0.5752 0.3027 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4161 1.8638 0.8238 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1236 -1.9528 -0.7201 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2359 -0.8098 -0.2946 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0233 -1.9949 -0.7968 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3772 -2.0854 -0.8396 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1600 -1.0394 -0.4191 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5565 -1.1242 -0.4598 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1403 2.7259 0.1049 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0836 2.1421 1.7987 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5323 3.1298 1.2154 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8295 1.1277 0.4701 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -1.6105 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8884 1.1689 0.4955 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8826 2.1685 0.9099 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3658 1.5922 0.6955 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0455 -0.8992 -0.3205 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6698 -2.5115 -0.9667 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9978 -3.2851 -1.2697 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1682 1.1723 0.5334 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3440 2.3399 1.2168 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7123 1.8150 1.7014 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9100 2.4701 0.0551 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8688 -1.2850 -0.8789 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2936 -1.2111 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3706 -2.8155 -1.1265 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8505 -2.9840 -1.2061 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0086 -1.7873 0.1764 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 10 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 17 22 1 0 8 23 1 0 5 24 2 0 24 25 1 0 25 26 2 0 26 27 1 0 26 3 1 0 19 14 1 0 1 28 1 0 1 29 1 0 1 30 1 0 4 31 1 0 6 32 1 0 7 33 1 0 9 34 1 0 12 35 1 0 13 36 1 0 15 37 1 0 16 38 1 0 19 39 1 0 21 40 1 0 21 41 1 0 21 42 1 0 22 43 1 0 23 44 1 0 24 45 1 0 25 46 1 0 27 47 1 0 M END

Standard InCHIKey	ZIUSSTSXXLLKKK-KOBPDPAPSA-N
Standard InCHI	InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-13,22,24-25H,1-2H3/b7-3+,8-4+,16-13-
SMILES	COc1cc(/C=C/C(=C/C(=O)/C=C/c2ccc(c(c2)OC)O)/O)ccc1O

Calculated Properties

Physi-Chem Properties

Molecular Weight:	368.13	Volume:	381.036 ? Van der Waals volume.
Dense:	0.966	LogP:	2.975 ? The logarithm of the n-octanol/water distribution coefficients.
logD7.4:	2.883 ? The logarithm of the n-octanol/water distribution coefficient at pH=7.4.	LogS:	-3.97 ? The logarithm of aqueous solubility value.
Rotatable Bonds:	7.0	Rigid Bonds:	16.0
TPSA:	96.22 ? Topological Polar Surface Area.	H-Bond Acceptor:	6.0
H-Bond Donor:	3.0	Rings:	2.0
Heavy Atoms:	6.0

MedChem Properties

QED Drug-Likeness Score:	0.39	GASA:	0.0 ? GASA represents the probability of being difficult to synthesize, ranging from 0 to 1.
Synthetic Accessibility Score:	2.613	Fsp³:	0.095
MCE-18:	14.0 ? MCE-18 stands for medicinal chemistry evolution.MCE-18≥45 is considered a suitable value.	Lipinski Rule-of-5:	Rejected
Pfizer Rule:	Rejected	GSK Rule:	Rejected
Golden Triangle Rule:	Rejected	BMS Rule:	0
Chelating Alert:	1	PAINS Alert:	0
Colloidal aggregators:	0.98	Fluc inhibitor:	1.0 ? The fluc inhibitor value is the probability of being fLuc inhibitors, within the range of 0 to 1.
Blue fluorescence:	0.335 ? The blue fluorescence value is the probability of being blue fluorescence, within the range of 0 to 1	Green fluorescence:	0.734 ? The green fluorescence value is the probability of being green fluorescence, within the range of 0 to 1
Reactive compounds:	0.671	Promiscuous compounds:	0.455

ADMET Properties (ADMETlab3.0)

ADMET: Absorption

Caco-2 Permeability:	-5.181	MDCK Permeability:	-4.859
Pgp-inhibitor:	0.339	Pgp-substrate:	0.001
PAMPA:	0.038 ? The experimental data for Peff was logarithmically transformed (logPeff). Molecules with log Peff values below 2.0 were classified as low-permeability (Category 0), while those with log Peff values exceeding 2.5 were classified as high-permeability (Category 1).	Human Intestinal Absorption (HIA):	0.026
20% Bioavailability (F20%):	0.99	30% Bioavailability (F30%):	0.994
50% Bioavailability (F50%):	1.0

ADMET: Distribution

Blood-Brain-Barrier Penetration (BBB):	0.0	MRP1:	0.003
Plasma Protein Binding (PPB):	95.885%	Volume Distribution (VD):	-0.592
Fu:	4.209% ? The fraction unbound in plasms.	OATP1B1 inhibitor:	1.0
OATP1B3 inhibitor:	1.0	BCRP inhibitor:	0.916
BSEP inhibitor:	1.0

ADMET: Metabolism

CYP1A2-inhibitor:	0.001	CYP1A2-substrate:	0.211
CYP2C19-inhibitor:	0.001	CYP2C19-substrate:	0.123
CYP2C9-inhibitor:	0.106	CYP2C9-substrate:	0.075
CYP2D6-inhibitor:	1.0	CYP2D6-substrate:	0.347
CYP3A4-inhibitor:	0.049	CYP3A4-substrate:	0.477
CYP2B6-substrate:	0.007	CYP2C8-inhibitor:	1.0
HLM stability:	0.943 ? Human liver microsomal (HLM) stability. Category 0: stable+ (HLM > 30 min); Category 1: unstable- (HLM ≤ 30 min). The output value is the probability of human liver microsomal instability, where a value closer to 1 indicates a higher likelihood of instability.

ADMET: Excretion

Clearance (CL):

7.654

Half-life (T1/2):

1.097

ADMET: Toxicity

hERG Blockers:	0.082	hERG Blockers (10um):	0.112
Human Hepatotoxicity (H-HT):	0.658	Drug-induced Liver Injury (DILI):	0.803
AMES Toxicity:	0.442	Rat Oral Acute Toxicity:	0.199
Maximum Recommended Daily Dose:	0.603	Skin Sensitization:	0.934
Carcinogencity:	0.402	Eye Corrosion:	0.011
Eye Irritation:	0.966	Respiratory Toxicity:	0.751
Drug-induced Neurotoxicity:	0.335	Ototoxicity:	0.429
Hematotoxicity:	0.162	Drug-induced Nephrotoxicity:	0.711
Genotoxicity:	0.544	RPMI-8226 Immunitoxicity:	0.149
A549 Cytotoxicity:	0.205	Hek293 Cytotoxicity:	0.346
BCF:	1.073 ? Bioconcentration factors are used for considering secondary poisoning potential and assessing risks to human health via the food chain. The unit is -log10[(mg/L)/(1000*MW)].	IGC50:	3.498 ? 48 hour Tetrahymena pyriformis IGC50. The unit of IGC50 is -log10[(mg/L)/(1000*MW)].
LC50DM:	4.498 ? 48 hour Daphnia magna LC50. The unit of LC50DM is -log10[(mg/L)/(1000*MW)].	LC50FM:	4.021 ? 96 hour fathead minnow LC50. The unit of LC50FM is -log10[(mg/L)/(1000*MW)].

Species Source

Organism ID	Organism Name	Taxonomy Level	Family	SuperKingdom	Isolation Part	Collection Location	Collection Time	Reference
NPO64603	Curcuma wenyujin + Chaetomium globosum symbiont	Species	n.a.	n.a.	n.a.	n.a.	n.a.	PMID[ 22112725]
NPO44190	Curcuma longa L.	Genus	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	DOI[10.1016/j.indcrop.2016.05.007]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	Flowers	n.a.	n.a.	DOI[10.5897/JMPR.9000078]
NPO6836	Alpinia blepharocalyx	Species	Zingiberaceae	Eukaryota	seeds	Mengha, Yunnan Province, China	1991-Aug	PMID[11277741]
NPO6836	Alpinia blepharocalyx	Species	Zingiberaceae	Eukaryota	seeds	n.a.	n.a.	PMID[11325233]
NPO6836	Alpinia blepharocalyx	Species	Zingiberaceae	Eukaryota	Seeds	n.a.	n.a.	PMID[11430002]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	n.a.	flower	n.a.	PMID[12130858]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[12350137]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	rhizome	n.a.	n.a.	PMID[12617587]
NPO40808	Daucus Carota	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[16180819]
NPO21995	Gelsemium elegans	Species	Gelsemiaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[16643063]
NPO21995	Gelsemium elegans	Species	Gelsemiaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[16989532]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	n.a.	root	n.a.	PMID[18484537]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	n.a.	rhizome	n.a.	PMID[18484537]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	rhizomes	n.a.	n.a.	PMID[19615910]
NPO33471	Zingiber spectabile	Species	Zingiberaceae	Eukaryota	rhizomes	n.a.	n.a.	PMID[22546674]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	Rhizomes	n.a.	n.a.	PMID[23153397]
NPO2618	Curcuma wenyujin	Species	Zingiberaceae	Eukaryota	n.a.	root	n.a.	PMID[23738470]
NPO2618	Curcuma wenyujin	Species	Zingiberaceae	Eukaryota	n.a.	rhizome	n.a.	PMID[23738470]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	leaf	n.a.	PMID[23901173]
NPO21995	Gelsemium elegans	Species	Gelsemiaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[24256496]
NPO8797	Cudrania tricuspidata	Species	Moraceae	Eukaryota	Root barks	n.a.	n.a.	PMID[25051453]
NPO4314	Gnetum africanum	Species	Gnetaceae	Eukaryota	Rhizomes	n.a.	n.a.	PMID[25093453]
NPO2618	Curcuma wenyujin	Species	Zingiberaceae	Eukaryota	Rhizomes	n.a.	n.a.	PMID[25275213]
NPO33577	Pyxidicoccus fallax	Species	Myxococcaceae	Bacteria	n.a.	n.a.	n.a.	PMID[25686392]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	PMID[26099993]
NPO21995	Gelsemium elegans	Species	Gelsemiaceae	Eukaryota	leaves and vine stems	Xishuangbanna Tropical Botanical Garden (XTBG), Chinese Academy of Science (CAS), Mengla County, Yunnan Province, China	2009-OCT	PMID[26103517]
NPO21995	Gelsemium elegans	Species	Gelsemiaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[26222693]
NPO8797	Cudrania tricuspidata	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	PMID[27420919]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[28068085]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	Flowers	n.a.	n.a.	PMID[28156114]
NPO25209	Curcuma aromatica	Species	Zingiberaceae	Eukaryota	Radix	n.a.	n.a.	PMID[29236488]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[29323912]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	PMID[29400471]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	Aerial Parts	n.a.	n.a.	PMID[30726671]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	n.a.	rhizome	n.a.	PMID[731398]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	n.a.	root	n.a.	PMID[731398]
NPO6836	Alpinia blepharocalyx	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[9461664]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[9584408]
NPO7929	Curcuma zedoaria	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[9868158]
NPO33283	zedoariae rhizoma	n.a.	n.a.	n.a.	n.a.	n.a.	n.a.	PMID[9871681]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO2618	Curcuma wenyujin	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO9241	Adiantum capillus-veneris	Species	Pteridaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO25209	Curcuma aromatica	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO7929	Curcuma zedoaria	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO7308	Fraxinus quadrangulata	Species	Oleaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO25160	Goniothalamus borneensis	Species	Annonaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO3251	Jacobaea maritima	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO3532	Tridentata marginata	n.a.	n.a.	n.a.	n.a.	n.a.	n.a.	Database[COCONUT]
NPO6836	Alpinia blepharocalyx	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO44190	Curcuma longa L.	Genus	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO31101	Acarus calamus	Species	Acaridae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO21995	Gelsemium elegans	Species	Gelsemiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO4314	Gnetum africanum	Species	Gnetaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO33577	Pyxidicoccus fallax	Species	Myxococcaceae	Bacteria	n.a.	n.a.	n.a.	Database[COCONUT]
NPO33471	Zingiber spectabile	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[COCONUT]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	Essential Oil	n.a.	n.a.	Database[FooDB]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	Leaf	n.a.	n.a.	Database[FooDB]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	Rhizome	n.a.	n.a.	Database[FooDB]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	Rhizome Essent. Oil	n.a.	n.a.	Database[FooDB]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	Root	n.a.	n.a.	Database[FooDB]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota		n.a.	n.a.	Database[FooDB]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	n.a.		Database[FooDB]
NPO25209	Curcuma aromatica	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO6836	Alpinia blepharocalyx	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO21995	Gelsemium elegans	Species	Gelsemiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO7929	Curcuma zedoaria	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO9241	Adiantum capillus-veneris	Species	Pteridaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO7308	Fraxinus quadrangulata	Species	Oleaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1002/anie.201706342]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1002/bit.25914]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1002/bit.26941]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1002/bit.27254]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1002/bit.27344]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1002/bit.28008]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1007/s00253-014-6092-x]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1007/s00253-021-11545-y]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1007/s00253-022-11898-y]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1007/s10295-020-02259-7]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1007/s10529-006-9142-3]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1007/s12257-017-0290-1]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.bej.2021.108178]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.biortech.2019.122600]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.biortech.2020.124362]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.biortech.2022.128320]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.enzmictec.2019.109392]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.jbiosc.2014.10.021]
NPO41103	Escherichia coli BL21	Strain	Enterobacteriaceae	Bacteria	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.jbiotec.2018.06.304]
NPO41103	Escherichia coli BL21	Strain	Enterobacteriaceae	Bacteria	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.jtice.2021.08.038]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.micres.2020.126669]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.procbio.2008.04.027]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.synbio.2021.06.003]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.synbio.2022.03.001]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.ymben.2013.12.004]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.ymben.2015.03.011]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.ymben.2016.10.021]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.ymben.2018.04.002]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.ymben.2019.10.002]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.ymben.2019.12.002]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.ymben.2021.08.003]
NPO41103	Escherichia coli BL21	Strain	Enterobacteriaceae	Bacteria	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1016/j.ymben.2022.11.004]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acs.jafc.0c04276]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acs.jafc.0c07886]
NPO41103	Escherichia coli BL21	Strain	Enterobacteriaceae	Bacteria	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acs.jafc.1c03309]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acs.jafc.1c05486]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acs.jafc.2c00754]
NPO41103	Escherichia coli BL21	Strain	Enterobacteriaceae	Bacteria	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acs.jafc.8b01299]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acs.jafc.8b05014]
NPO41103	Escherichia coli BL21	Strain	Enterobacteriaceae	Bacteria	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acs.jafc.9b00413]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acsomega.0c04590]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acssynbio.2c00298]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acssynbio.7b00128]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acssynbio.7b00385]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acssynbio.8b00198]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1021/acssynbio.9b00479]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1038/s41467-019-08781-2]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1038/s41467-020-14918-5]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1038/s41929-022-00820-4]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1093/synbio/ysaa012]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1128/AEM.01971-10]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1186/s12934-020-01300-9]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1186/s13765-021-00595-5]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.1371/journal.pbio.3000347]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.3389/fbioe.2019.00279]
NPO41103	Escherichia coli BL21	Strain	Enterobacteriaceae	Bacteria	n.a.	n.a.	n.a.	DOI[https://doi.org/10.3389/fbioe.2020.00059]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.3389/fmicb.2022.902848]
NPO65078	A new engineered strain of Escherichia coli	Species	n.a.	n.a.	n.a.	n.a.	n.a.	DOI[https://doi.org/10.3390/biom12070997]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	n.a.		Database[Phenol-Explorer]
NPO7308	Fraxinus quadrangulata	Species	Oleaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO25209	Curcuma aromatica	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO21995	Gelsemium elegans	Species	Gelsemiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO7929	Curcuma zedoaria	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO6836	Alpinia blepharocalyx	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO9241	Adiantum capillus-veneris	Species	Pteridaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO8797	Cudrania tricuspidata	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO3251	Jacobaea maritima	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO31101	Acarus calamus	Species	Acaridae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO7929	Curcuma zedoaria	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO2618	Curcuma wenyujin	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO9241	Adiantum capillus-veneris	Species	Pteridaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO25209	Curcuma aromatica	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO2618	Curcuma wenyujin	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO7929	Curcuma zedoaria	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO25160	Goniothalamus borneensis	Species	Annonaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO3532	Tridentata marginata	n.a.	n.a.	n.a.	n.a.	n.a.	n.a.	Database[UNPD]
NPO6836	Alpinia blepharocalyx	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25209	Curcuma aromatica	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO9241	Adiantum capillus-veneris	Species	Pteridaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO7929	Curcuma zedoaria	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO23911	Alpinia officinarum	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO2618	Curcuma wenyujin	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO7308	Fraxinus quadrangulata	Species	Oleaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO3251	Jacobaea maritima	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO22258	Chrysanthemum indicum	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO24124	Curcuma longa	Species	Zingiberaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO21995	Gelsemium elegans	Species	Gelsemiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO4314	Gnetum africanum	Species	Gnetaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO8797	Cudrania tricuspidata	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]

Note for Reference:
In addition to directly collecting NP source organism data from primary literature (where reference will provided as NCBI PMID or DOI links), NPASS also integrated them from below databases:
☉ UNPD: Universal Natural Products Database [PMID: 23638153].
☉ StreptomeDB: a database of streptomycetes natural products [PMID: 33051671].
☉ TM-MC: a database of medicinal materials and chemical compounds in Northeast Asian traditional medicine [PMID: 26156871].
☉ TCM@Taiwan: a Traditional Chinese Medicine database [PMID: 21253603].
☉ TCMID: a Traditional Chinese Medicine database [PMID: 29106634].
☉ TCMSP: The traditional Chinese medicine systems pharmacology database and analysis platform [PMID: 24735618].
☉ HerDing: a herb recommendation system to treat diseases using genes and chemicals [PMID: 26980517].
☉ MetaboLights: a metabolomics database [PMID: 27010336].
☉ FooDB: a database of constituents, chemistry and biology of food species [www.foodb.ca].

NP Quantity Composition/Concentration

Organism ID	Organism Name	Organism Material Preparation	Organism Part	NP Quantity (Standard)	NP Quantity (Minimum)	NP Quantity (Maximum)	Quantity Unit	Reference

Note for Reference:
In addition to directly collecting NP quantitative data from primary literature (where reference will provided as NCBI PMID or DOI links), NPASS also integrated NP quantitative records for specific NP domains (e.g., NPS from foods or herbs) from domain-specific databases. These databases include:
☉ DUKE: Dr. Duke's Phytochemical and Ethnobotanical Databases.
☉ PHENOL EXPLORER: is the first comprehensive database on polyphenol content in foods [PMID: 24103452], its homepage can be accessed at here.
☉ FooDB: a database of constituents, chemistry and biology of food species [www.foodb.ca].

Biological Activity

Activity Type	# Activity
IC50	413
Inhibition	186
Ki	21
Kcat	4
Kcat/Km	4
Activity	206
EC50	48
Potency	83
TIME	4
FC	22
Imax	1
Thermal melting change	59
MIC	45
ED50	10
Viability	1
IC90	4
IC70	3
GC50	2
IZ	25
CD50	1
Stability	4
Ratio IC50	17
Kd	3
MTD	1
Ratio	5
MIC90	4
GI50	10
Ratio CC50/IC50	3
deltaA	1
TGI	3
MIC95	7
GI	1
ED10	1
ED25	1
MEC	1
MTC	1
log2FC	27
logMIC	1
Hit score	1
CC50	23
pCC50	1
Bioavailability Increase	2
Survival	4

Activity Type	# Activity
Individual protein	317
Cell line	420
Single protein	3
Organism	202
Others	219
Protein family	4
Protein complex	5
Tissue	6
Protein-protein interaction	6
Non-molecular	82

Molecular-level activity

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference
NPT12	Individual protein	Human immunodeficiency virus type 1 integrase	Human immunodeficiency virus 1	IC50	=	150000.0	nM	PMID[9301668]
NPT12	Individual protein	Human immunodeficiency virus type 1 integrase	Human immunodeficiency virus 1	IC50	=	140000.0	nM	PMID[9301668]
NPT12	Individual protein	Human immunodeficiency virus type 1 integrase	Human immunodeficiency virus 1	IC50	=	30000.0	nM	PMID[9767632]
NPT12	Individual protein	Human immunodeficiency virus type 1 integrase	Human immunodeficiency virus 1	IC50	=	57500.0	nM	PMID[10969990]
NPT12	Individual protein	Human immunodeficiency virus type 1 integrase	Human immunodeficiency virus 1	IC50	=	30199.52	nM	PMID[11831895]
NPT324	Individual protein	Cyclooxygenase-1	Ovis aries	Inhibition	=	80.5	%	PMID[15780608]
NPT325	Individual protein	Cyclooxygenase-2	Ovis aries	Inhibition	=	35.0	%	PMID[15780608]
NPT31	Individual protein	Cyclooxygenase-2	Homo sapiens	IC50	=	11060.0	nM	PMID[15780608]
NPT1079	Individual protein	Histone acetyltransferase p300	Homo sapiens	IC50	>	400000.0	nM	PMID[17348637]
NPT30	Individual protein	Cyclooxygenase-1	Homo sapiens	IC50	=	52000.0	nM	PMID[18077363]
NPT3517	Individual protein	Nitric oxide synthase, inducible	Homo sapiens	IC50	=	6000.0	nM	PMID[18077363]
NPT212	Individual protein	Cytochrome P450 2C9	Homo sapiens	IC50	=	4300.0	nM	PMID[18249473]
NPT109	Individual protein	Cytochrome P450 3A4	Homo sapiens	IC50	=	16300.0	nM	PMID[18249473]
NPT208	Individual protein	Cytochrome P450 1A2	Homo sapiens	IC50	=	40000.0	nM	PMID[18249473]
NPT110	Individual protein	Cytochrome P450 2D6	Homo sapiens	IC50	=	50300.0	nM	PMID[18249473]
NPT1821	Individual protein	Sortase	Staphylococcus aureus	IC50	=	13.8	ug.mL-1	PMID[19269184]
NPT30	Individual protein	Cyclooxygenase-1	Homo sapiens	IC50	=	8800.0	nM	PMID[16038536]
NPT1079	Individual protein	Histone acetyltransferase p300	Homo sapiens	IC50	>	40000.0	nM	PMID[19114310]
NPT280	Individual protein	Matrix metalloproteinase 9	Homo sapiens	IC50	=	8500.0	nM	PMID[19128977]
NPT1090	Individual protein	Matrix metalloproteinase 13	Homo sapiens	IC50	=	10300.0	nM	PMID[18358729]
NPT12	Individual protein	Human immunodeficiency virus type 1 integrase	Human immunodeficiency virus 1	IC50	=	51.3	ug.mL-1	PMID[16643034]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Kcat	=	2.6	/s	PMID[19388706]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Kcat	=	4.3	/s	PMID[19388706]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Kcat	=	5.0	/s	PMID[19388706]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Kcat	=	6.5	/s	PMID[19388706]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Kcat/Km	=	4.8	/uM/s	PMID[19388706]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Kcat/Km	=	6.5	/uM/s	PMID[19388706]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Kcat/Km	=	5.1	/uM/s	PMID[19388706]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Kcat/Km	=	3.9	/uM/s	PMID[19388706]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Activity	=	160.0	nM/s	PMID[19388706]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Activity	=	150.0	nM/s	PMID[19388706]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Inhibition	=	60.0	%	PMID[19388706]
NPT1310	Individual protein	Xanthine dehydrogenase	Bos taurus	Inhibition	>	20.0	%	PMID[19388706]
NPT1573	Individual protein	Enoyl-[acyl-carrier-protein] reductase	Escherichia coli K-12	Ki	=	14960.0	nM	PMID[19959361]
NPT2752	Individual protein	DNA (cytosine-5)-methyltransferase 1	Homo sapiens	Inhibition	=	66.0	%	PMID[20006515]
NPT12	Individual protein	Human immunodeficiency virus type 1 integrase	Human immunodeficiency virus 1	IC50	=	40000.0	nM	PMID[19813754]
NPT202	Individual protein	Protease	Human immunodeficiency virus 1	IC50	=	100000.0	nM	PMID[23742639]
NPT233	Individual protein	Carbonic anhydrase II	Homo sapiens	Ki	=	380.0	nM	PMID[20674354]
NPT1146	Individual protein	Carbonic anhydrase III	Homo sapiens	Ki	=	11300.0	nM	PMID[20674354]
NPT1062	Individual protein	Carbonic anhydrase IV	Homo sapiens	Ki	=	4970.0	nM	PMID[20674354]
NPT1143	Individual protein	Carbonic anhydrase VA	Homo sapiens	Ki	=	10250.0	nM	PMID[20674354]
NPT1144	Individual protein	Carbonic anhydrase VB	Homo sapiens	Ki	=	9460.0	nM	PMID[20674354]
NPT1063	Individual protein	Carbonic anhydrase VI	Homo sapiens	Ki	=	9940.0	nM	PMID[20674354]
NPT3101	Individual protein	Carbonic anhydrase XIII	Homo sapiens	Ki	=	6850.0	nM	PMID[20674354]
NPT1147	Individual protein	Carbonic anhydrase 15	Mus musculus	Ki	=	5090.0	nM	PMID[20674354]
NPT149	Individual protein	Endoplasmic reticulum-associated amyloid beta-peptide-binding protein	Homo sapiens	Potency	=	25118.9	nM	PubChem BioAssay data set
NPT2930	Individual protein	Hemoglobin beta chain	Homo sapiens	Potency	=	25118.9	nM	PubChem BioAssay data set
NPT1038	Individual protein	Histone-lysine N-methyltransferase MLL	Homo sapiens	Potency	=	44668.4	nM	PubChem BioAssay data set
NPT3	Individual protein	Thioredoxin glutathione reductase	Schistosoma mansoni	Potency	=	12589.3	nM	PubChem BioAssay data set
NPT282	Individual protein	MAP kinase ERK2	Homo sapiens	Potency	=	10000.0	nM	PubChem BioAssay data set
NPT2930	Individual protein	Hemoglobin beta chain	Homo sapiens	Potency	=	31622.8	nM	PubChem BioAssay data set
NPT151	Individual protein	15-hydroxyprostaglandin dehydrogenase [NAD+]	Homo sapiens	Potency	=	22387.2	nM	PubChem BioAssay data set
NPT109	Individual protein	Cytochrome P450 3A4	Homo sapiens	Potency	=	25118.9	nM	PubChem BioAssay data set
NPT1566	Individual protein	Glyoxalase I	Homo sapiens	Ki	=	10000.0	nM	PMID[21237663]
NPT1120	Individual protein	Pancreatic triacylglycerol lipase	Sus scrofa	IC50	>	250000.0	nM	PMID[21282056]
NPT30	Individual protein	Cyclooxygenase-1	Homo sapiens	Inhibition	=	59.01	%	PMID[21345672]
NPT31	Individual protein	Cyclooxygenase-2	Homo sapiens	Inhibition	=	20.32	%	PMID[21345672]
NPT30	Individual protein	Cyclooxygenase-1	Homo sapiens	IC50	=	35090.0	nM	PMID[21345672]
NPT31	Individual protein	Cyclooxygenase-2	Homo sapiens	IC50	=	79200.0	nM	PMID[21345672]
NPT226	Individual protein	Beta-2 adrenergic receptor	Homo sapiens	Potency	n.a.	23109.3	nM	PubChem BioAssay data set
NPT1005	Individual protein	Tumor susceptibility gene 101 protein	Homo sapiens	Potency	n.a.	31622.8	nM	PubChem BioAssay data set
NPT1139	Individual protein	Arachidonate 15-lipoxygenase, type II	Homo sapiens	Potency	n.a.	10000.0	nM	PubChem BioAssay data set
NPT1566	Individual protein	Glyoxalase I	Homo sapiens	Ki	=	10300.0	nM	PMID[21689932]
NPT198	Individual protein	Vitamin D receptor	Homo sapiens	Potency	n.a.	44668.4	nM	PubChem BioAssay data set
NPT198	Individual protein	Vitamin D receptor	Homo sapiens	Potency	n.a.	50118.7	nM	PubChem BioAssay data set
NPT198	Individual protein	Vitamin D receptor	Homo sapiens	Potency	n.a.	39810.7	nM	PubChem BioAssay data set
NPT199	Individual protein	DNA polymerase kappa	Homo sapiens	Potency	n.a.	31622.8	nM	PubChem BioAssay data set
NPT154	Individual protein	Mothers against decapentaplegic homolog 3	Homo sapiens	Potency	n.a.	35481.3	nM	PubChem BioAssay data set
NPT226	Individual protein	Beta-2 adrenergic receptor	Homo sapiens	Potency	n.a.	6513.1	nM	PubChem BioAssay data set
NPT10	Individual protein	Geminin	Homo sapiens	Potency	n.a.	33498.3	nM	PubChem BioAssay data set
NPT10	Individual protein	Geminin	Homo sapiens	Potency	n.a.	18356.4	nM	PubChem BioAssay data set
NPT100	Individual protein	Glutaminase kidney isoform, mitochondrial	Homo sapiens	Potency	n.a.	35481.3	nM	PubChem BioAssay data set
NPT10	Individual protein	Geminin	Homo sapiens	Potency	n.a.	23109.3	nM	PubChem BioAssay data set
NPT10	Individual protein	Geminin	Homo sapiens	Potency	n.a.	29855.4	nM	PubChem BioAssay data set
NPT152	Individual protein	Nuclear factor erythroid 2-related factor 2	Homo sapiens	Potency	n.a.	22387.2	nM	PubChem BioAssay data set
NPT1417	Individual protein	Transcriptional regulator ERG	Homo sapiens	Potency	n.a.	15848.9	nM	PubChem BioAssay data set
NPT1674	Individual protein	CaM kinase II alpha	Homo sapiens	IC50	=	13000.0	nM	PMID[22989913]
NPT1674	Individual protein	CaM kinase II alpha	Homo sapiens	IC50	=	21000.0	nM	PMID[22989913]
NPT1674	Individual protein	CaM kinase II alpha	Homo sapiens	IC50	=	45000.0	nM	PMID[22989913]
NPT1674	Individual protein	CaM kinase II alpha	Homo sapiens	IC50	=	34000.0	nM	PMID[22989913]
NPT1674	Individual protein	CaM kinase II alpha	Homo sapiens	IC50	=	33000.0	nM	PMID[22989913]
NPT1674	Individual protein	CaM kinase II alpha	Homo sapiens	IC50	=	37000.0	nM	PMID[22989913]
NPT1044	Individual protein	DNA topoisomerase II alpha	Homo sapiens	IC50	=	15000.0	nM	DOI[10.1007/s00044-011-9587-3]
NPT285	Individual protein	Epidermal growth factor receptor erbB1	Homo sapiens	IC50	=	8600.0	nM	PMID[23245570]
NPT198	Individual protein	Vitamin D receptor	Homo sapiens	FC	=	8.0	n.a.	PMID[23276449]
NPT198	Individual protein	Vitamin D receptor	Homo sapiens	EC50	=	20000.0	nM	PMID[23276449]
NPT160	Individual protein	TAR DNA-binding protein 43	Homo sapiens	Potency	n.a.	35481.3	nM	PubChem BioAssay data set
NPT204	Individual protein	Acetylcholinesterase	Homo sapiens	Imax	=	35.1	%	PMID[23501115]
NPT1137	Individual protein	11-beta-hydroxysteroid dehydrogenase 1	Homo sapiens	IC50	=	15983.0	nM	PMID[23800686]
NPT1138	Individual protein	11-beta-hydroxysteroid dehydrogenase 2	Homo sapiens	IC50	=	15696.0	nM	PMID[23800686]
NPT1137	Individual protein	11-beta-hydroxysteroid dehydrogenase 1	Homo sapiens	IC50	=	4501.0	nM	PMID[23800686]
NPT2553	Individual protein	Aminopeptidase N	Homo sapiens	IC50	=	10000.0	nM	PMID[23860593]
NPT1553	Individual protein	Aminopeptidase N	Sus scrofa	IC50	=	15500.0	nM	PMID[23860593]
NPT161	Individual protein	Rap guanine nucleotide exchange factor 4	Homo sapiens	Potency	n.a.	35481.3	nM	PubChem BioAssay data set
NPT1119	Individual protein	Arachidonate 12-lipoxygenase	Homo sapiens	Inhibition	=	65.0	%	PMID[24920381]
NPT30	Individual protein	Cyclooxygenase-1	Homo sapiens	IC50	=	8100.0	nM	PMID[24920381]
NPT152	Individual protein	Nuclear factor erythroid 2-related factor 2	Homo sapiens	EC50	=	9900.0	nM	PMID[24920381]
NPT270	Individual protein	Nitric oxide synthase, inducible	Mus musculus	Inhibition	=	97.0	%	PMID[25058929]
NPT270	Individual protein	Nitric oxide synthase, inducible	Mus musculus	IC50	=	800.0	nM	PMID[25058929]
NPT324	Individual protein	Cyclooxygenase-1	Ovis aries	IC50	=	29650.0	nM	PMID[24938495]
NPT31	Individual protein	Cyclooxygenase-2	Homo sapiens	IC50	>	100000.0	nM	PMID[24938495]
NPT1032	Individual protein	Neuraminidase	Influenza A virus (strain A/USSR/90/1977 H1N1)	IC50	=	10000.0	nM	PMID[25277281]
NPT1032	Individual protein	Neuraminidase	Influenza A virus (strain A/USSR/90/1977 H1N1)	IC50	=	8100.0	nM	PMID[25277281]
NPT2704	Individual protein	Hemagglutinin	Influenza A virus	Activity	=	16.1	n.a.	PMID[25681711]
NPT2704	Individual protein	Hemagglutinin	Influenza A virus	Activity	=	6.8	n.a.	PMID[25681711]
NPT2704	Individual protein	Hemagglutinin	Influenza A virus	Activity	=	2.7	n.a.	PMID[25681711]
NPT2704	Individual protein	Hemagglutinin	Influenza A virus	Activity	=	0.8	n.a.	PMID[25681711]
NPT1079	Individual protein	Histone acetyltransferase p300	Homo sapiens	Inhibition	=	93.45	%	PMID[25730130]
NPT1079	Individual protein	Histone acetyltransferase p300	Homo sapiens	IC50	=	6500.0	nM	PMID[25730130]
NPT1671	Individual protein	AMP-activated protein kinase, alpha-2 subunit	Homo sapiens	Thermal melting change	=	-0.1	degrees C	PMID[18077363]
NPT1672	Individual protein	CaM kinase I delta	Homo sapiens	Thermal melting change	=	2.0	degrees C	PMID[18077363]
NPT1673	Individual protein	CaM kinase I gamma	Homo sapiens	Thermal melting change	=	1.3	degrees C	PMID[18077363]
NPT1674	Individual protein	CaM kinase II alpha	Homo sapiens	Thermal melting change	=	-0.1	degrees C	PMID[18077363]
NPT1630	Individual protein	CaM kinase II beta	Homo sapiens	Thermal melting change	=	1.0	degrees C	PMID[18077363]
NPT1675	Individual protein	CaM kinase II delta	Homo sapiens	Thermal melting change	=	0.1	degrees C	PMID[18077363]
NPT1676	Individual protein	CaM kinase II gamma	Homo sapiens	Thermal melting change	=	-0.2	degrees C	PMID[18077363]
NPT1677	Individual protein	CaM kinase IV	Homo sapiens	Thermal melting change	=	2.1	degrees C	PMID[18077363]
NPT1678	Individual protein	CaM-kinase kinase beta	Homo sapiens	Thermal melting change	=	6.1	degrees C	PMID[18077363]
NPT1371	Individual protein	Cyclin-dependent kinase 2	Homo sapiens	Thermal melting change	=	1.9	degrees C	PMID[18077363]
NPT1571	Individual protein	Cyclin-dependent kinase 6	Homo sapiens	Thermal melting change	=	2.1	degrees C	PMID[18077363]
NPT1679	Individual protein	Cyclin-dependent kinase-like 1	Homo sapiens	Thermal melting change	=	3.9	degrees C	PMID[18077363]
NPT1680	Individual protein	Serine/threonine-protein kinase Chk2	Homo sapiens	Thermal melting change	=	5.4	degrees C	PMID[18077363]
NPT1682	Individual protein	Dual specificity protein kinase CLK2	Homo sapiens	Thermal melting change	=	2.6	degrees C	PMID[18077363]
NPT1683	Individual protein	Dual specificity protein kinase CLK3	Homo sapiens	Thermal melting change	=	3.6	degrees C	PMID[18077363]
NPT1684	Individual protein	Casein kinase I gamma 1	Homo sapiens	Thermal melting change	=	4.5	degrees C	PMID[18077363]
NPT1685	Individual protein	Casein kinase I gamma 2	Homo sapiens	Thermal melting change	=	2.3	degrees C	PMID[18077363]
NPT1686	Individual protein	Casein kinase I isoform gamma-3	Homo sapiens	Thermal melting change	=	0.3	degrees C	PMID[18077363]
NPT1687	Individual protein	Death-associated protein kinase 3	Homo sapiens	Thermal melting change	=	1.8	degrees C	PMID[18077363]
NPT1688	Individual protein	Myotonin-protein kinase	Homo sapiens	Thermal melting change	=	1.5	degrees C	PMID[18077363]
NPT1689	Individual protein	Tyrosine-protein kinase JAK1	Homo sapiens	Thermal melting change	=	4.1	degrees C	PMID[18077363]
NPT1690	Individual protein	Dual specificity mitogen-activated protein kinase kinase 2	Homo sapiens	Thermal melting change	=	2.8	degrees C	PMID[18077363]
NPT1691	Individual protein	Dual specificity mitogen-activated protein kinase kinase 6	Homo sapiens	Thermal melting change	=	4.0	degrees C	PMID[18077363]
NPT1431	Individual protein	Mitogen-activated protein kinase kinase kinase 5	Homo sapiens	Thermal melting change	=	3.1	degrees C	PMID[18077363]
NPT1616	Individual protein	MAP kinase p38 beta	Homo sapiens	Thermal melting change	=	3.7	degrees C	PMID[18077363]
NPT281	Individual protein	MAP kinase ERK1	Homo sapiens	Thermal melting change	=	0.8	degrees C	PMID[18077363]
NPT1692	Individual protein	Mitogen-activated protein kinase 6	Homo sapiens	Thermal melting change	=	1.8	degrees C	PMID[18077363]
NPT1693	Individual protein	Serine/threonine-protein kinase MST4	Homo sapiens	Thermal melting change	=	1.7	degrees C	PMID[18077363]
NPT1658	Individual protein	Serine/threonine-protein kinase NEK2	Homo sapiens	Thermal melting change	=	1.1	degrees C	PMID[18077363]
NPT1657	Individual protein	Serine/threonine-protein kinase NEK6	Homo sapiens	Thermal melting change	=	0.9	degrees C	PMID[18077363]
NPT1694	Individual protein	Serine/threonine-protein kinase OSR1	Homo sapiens	Thermal melting change	=	3.7	degrees C	PMID[18077363]
NPT1695	Individual protein	Serine/threonine-protein kinase PAK 4	Homo sapiens	Thermal melting change	=	3.0	degrees C	PMID[18077363]
NPT1696	Individual protein	Serine/threonine-protein kinase PAK7	Homo sapiens	Thermal melting change	=	1.3	degrees C	PMID[18077363]
NPT1697	Individual protein	Serine/threonine-protein kinase PAK6	Homo sapiens	Thermal melting change	=	1.6	degrees C	PMID[18077363]
NPT1698	Individual protein	Serine/threonine-protein kinase PCTAIRE-1	Homo sapiens	Thermal melting change	=	0.7	degrees C	PMID[18077363]
NPT1699	Individual protein	3-phosphoinositide dependent protein kinase-1	Homo sapiens	Thermal melting change	=	0.2	degrees C	PMID[18077363]
NPT1265	Individual protein	Serine/threonine-protein kinase PIM1	Homo sapiens	Thermal melting change	=	2.5	degrees C	PMID[18077363]
NPT1700	Individual protein	Serine/threonine-protein kinase PIM2	Homo sapiens	Thermal melting change	=	2.9	degrees C	PMID[18077363]
NPT1701	Individual protein	Serine/threonine-protein kinase PIM3	Homo sapiens	Thermal melting change	=	6.9	degrees C	PMID[18077363]
NPT1702	Individual protein	Serine/threonine-protein kinase PLK4	Homo sapiens	Thermal melting change	=	3.3	degrees C	PMID[18077363]
NPT1703	Individual protein	cAMP-dependent protein kinase alpha-catalytic subunit	Homo sapiens	Thermal melting change	=	3.4	degrees C	PMID[18077363]
NPT1704	Individual protein	Serine/threonine-protein kinase RIO2	Homo sapiens	Thermal melting change	=	2.8	degrees C	PMID[18077363]
NPT1705	Individual protein	Ribosomal protein S6 kinase alpha 3	Homo sapiens	Thermal melting change	=	3.4	degrees C	PMID[18077363]
NPT1705	Individual protein	Ribosomal protein S6 kinase alpha 3	Homo sapiens	Thermal melting change	=	3.0	degrees C	PMID[18077363]
NPT1706	Individual protein	Serine/threonine-protein kinase 2	Homo sapiens	Thermal melting change	=	3.2	degrees C	PMID[18077363]
NPT1707	Individual protein	Serine/threonine-protein kinase 10	Homo sapiens	Thermal melting change	=	6.1	degrees C	PMID[18077363]
NPT1708	Individual protein	Serine/threonine-protein kinase 16	Homo sapiens	Thermal melting change	=	0.9	degrees C	PMID[18077363]
NPT1709	Individual protein	Serine/threonine-protein kinase 17A	Homo sapiens	Thermal melting change	=	7.4	degrees C	PMID[18077363]
NPT1710	Individual protein	Serine/threonine-protein kinase 38	Homo sapiens	Thermal melting change	=	2.5	degrees C	PMID[18077363]
NPT1693	Individual protein	Serine/threonine-protein kinase MST4	Homo sapiens	Thermal melting change	=	2.9	degrees C	PMID[18077363]
NPT1711	Individual protein	Serine/threonine-protein kinase MST1	Homo sapiens	Thermal melting change	=	5.5	degrees C	PMID[18077363]
NPT1712	Individual protein	TRAF2- and NCK-interacting kinase	Homo sapiens	Thermal melting change	=	5.9	degrees C	PMID[18077363]
NPT1713	Individual protein	PDZ-binding kinase	Homo sapiens	Thermal melting change	=	0.7	degrees C	PMID[18077363]
NPT1715	Individual protein	Serine/threonine-protein kinase VRK2	Homo sapiens	Thermal melting change	=	1.4	degrees C	PMID[18077363]
NPT1717	Individual protein	Serine/threonine-protein kinase 25	Homo sapiens	Thermal melting change	=	4.4	degrees C	PMID[18077363]
NPT2794	Individual protein	Quinolone resistance protein norA	Staphylococcus aureus	MIC	=	1.0	ug.mL-1	DOI[10.1039/C4MD00196F]
NPT2794	Individual protein	Quinolone resistance protein norA	Staphylococcus aureus	FC	=	8.0	n.a.	DOI[10.1039/C4MD00196F]
NPT2795	Individual protein	Fluoroquinolone resistance protein	Staphylococcus aureus	MIC	=	256.0	ug.mL-1	DOI[10.1039/C4MD00196F]
NPT2795	Individual protein	Fluoroquinolone resistance protein	Staphylococcus aureus	FC	=	0.0	n.a.	DOI[10.1039/C4MD00196F]
NPT4244	Individual protein	RmtA	Emericella nidulans	IC50	=	1100000.0	nM	PMID[17323938]
NPT4250	Individual protein	Potassium channel subfamily K member 2	Bos taurus	IC50	=	930.0	nM	PMID[19653644]
NPT906	Individual protein	Testosterone 17-beta-dehydrogenase 3	Rattus norvegicus	IC50	=	9000.0	nM	PMID[20346654]
NPT906	Individual protein	Testosterone 17-beta-dehydrogenase 3	Rattus norvegicus	IC50	=	2300.0	nM	PMID[20346654]
NPT958	Individual protein	Estradiol 17-beta-dehydrogenase 3	Homo sapiens	IC50	=	67300.0	nM	PMID[20346654]
NPT955	Individual protein	Carbonic anhydrase VII	Homo sapiens	Ki	=	9300.0	nM	PMID[20674354]
NPT50	Individual protein	Tyrosyl-DNA phosphodiesterase 1	Homo sapiens	Potency	=	5623.4	nM	PubChem BioAssay data set
NPT531	Individual protein	Nuclear receptor ROR-gamma	Mus musculus	Potency	=	35481.3	nM	PubChem BioAssay data set
NPT531	Individual protein	Nuclear receptor ROR-gamma	Mus musculus	Potency	=	22387.2	nM	PubChem BioAssay data set
NPT531	Individual protein	Nuclear receptor ROR-gamma	Mus musculus	Potency	=	15848.9	nM	PubChem BioAssay data set
NPT801	Individual protein	Intestinal alkaline phosphatase	Homo sapiens	IC50	=	7410.0	nM	PubChem BioAssay data set
NPT801	Individual protein	Intestinal alkaline phosphatase	Homo sapiens	IC50	=	44100.0	nM	PubChem BioAssay data set
NPT4252	Individual protein	Toll-like receptor 9	Homo sapiens	IC50	=	15266.0	nM	PubChem BioAssay data set
NPT803	Individual protein	Flap endonuclease 1	Homo sapiens	Potency	n.a.	89125.1	nM	PubChem BioAssay data set
NPT4256	Individual protein	Islet amyloid polypeptide	Homo sapiens	Activity	=	15.1	/day	PMID[24900390]
NPT4256	Individual protein	Islet amyloid polypeptide	Homo sapiens	TIME	=	290.4	hr	PMID[24900390]
NPT4256	Individual protein	Islet amyloid polypeptide	Homo sapiens	TIME	=	408.0	hr	PMID[24900390]
NPT4257	Individual protein	Tubulin alpha 4a	Ovis aries	IC50	=	26600.0	nM	DOI[10.1007/s00044-010-9344-z]
NPT72	Individual protein	Solute carrier organic anion transporter family member 1B3	Homo sapiens	Inhibition	=	115.19	%	PMID[23571415]
NPT22961	Single protein	Inactive serine/threonine-protein kinase VRK3	Homo sapiens	Thermal melting change	=	1.3	degrees C	PMID[18077363]
NPT4245	Individual protein	Protein-arginine N-methyltransferase 1	Homo sapiens	IC50	=	1070000.0	nM	PMID[17323938]
NPT627	Individual protein	Cytochrome P450 2B6	Homo sapiens	IC50	=	24500.0	nM	PMID[18249473]
NPT4251	Individual protein	Cell division protein ftsZ	Bacillus subtilis (strain 168)	IC50	=	30000.0	nM	PMID[20615583]
NPT48	Individual protein	Lysine-specific demethylase 4D-like	Homo sapiens	Potency	=	19952.6	nM	PubChem BioAssay data set
NPT48	Individual protein	Lysine-specific demethylase 4D-like	Homo sapiens	Potency	=	28183.8	nM	PubChem BioAssay data set
NPT791	Individual protein	Cruzipain	Trypanosoma cruzi	Potency	=	25118.9	nM	PubChem BioAssay data set
NPT94	Individual protein	Aldehyde dehydrogenase 1A1	Homo sapiens	Potency	=	19952.6	nM	PubChem BioAssay data set
NPT798	Individual protein	Alkaline phosphatase placental-like	Homo sapiens	IC50	=	63500.0	nM	PubChem BioAssay data set
NPT802	Individual protein	Alkaline phosphatase, tissue-nonspecific isozyme	Homo sapiens	IC50	>	100000.0	nM	PubChem BioAssay data set
NPT68	Individual protein	Aldose reductase	Rattus norvegicus	Inhibition	=	12.0	%	PMID[21514701]
NPT444	Individual protein	Ubiquitin carboxyl-terminal hydrolase 1	Homo sapiens	Potency	n.a.	31622.8	nM	PubChem BioAssay data set
NPT444	Individual protein	Ubiquitin carboxyl-terminal hydrolase 1	Homo sapiens	Potency	n.a.	12589.3	nM	PubChem BioAssay data set
NPT484	Individual protein	Luciferin 4-monooxygenase	Photinus pyralis	Potency	n.a.	32196.8	nM	PubChem BioAssay data set
NPT477	Individual protein	DNA dC->dU-editing enzyme APOBEC-3G	Homo sapiens	Potency	n.a.	22387.2	nM	PubChem BioAssay data set
NPT740	Individual protein	Beta-secretase 1	Homo sapiens	IC50	=	5700.0	nM	PMID[23041347]
NPT67	Individual protein	Cholinesterase	Equus caballus	Inhibition	=	2.41	%	PMID[23062825]
NPT677	Individual protein	Coagulation factor III	Homo sapiens	IC50	=	199.63	nM	PMID[23199480]
NPT22562	Single protein	Anthrax toxin receptor 2	Homo sapiens	IC50	>	300000.0	nM	PMID[23394144]
NPT73	Individual protein	Solute carrier organic anion transporter family member 1B1	Homo sapiens	Inhibition	=	82.72	%	PMID[23571415]
NPT831	Individual protein	Serine/threonine-protein kinase PLK1	Homo sapiens	Potency	n.a.	1683.4	nM	PubChem BioAssay data set
NPT983	Protein complex	Nuclear factor NF-kappa-B complex	Homo sapiens	IC50	=	8000.0	nM	PMID[24775915]
NPT983	Protein complex	Nuclear factor NF-kappa-B complex	Homo sapiens	IC50	=	20900.0	nM	PMID[24920381]
NPT740	Individual protein	Beta-secretase 1	Homo sapiens	IC50	=	5300.0	nM	PMID[25088549]
NPT983	Protein complex	Nuclear factor NF-kappa-B complex	Homo sapiens	IC50	=	7.7	ug.mL-1	PMID[25881826]
NPT831	Individual protein	Serine/threonine-protein kinase PLK1	Homo sapiens	Thermal melting change	=	2.0	degrees C	PMID[18077363]
NPT692	Individual protein	Histone deacetylase 6	Homo sapiens	Inhibition	=	5.25	%	HDAC6 screening dataset using tau-based substrate in an enzymatic assay yields selective inhibitors and activators
NPT692	Individual protein	Histone deacetylase 6	Homo sapiens	Inhibition	=	38.8	%	HDAC6 screening dataset using tau-based substrate in an enzymatic assay yields selective inhibitors and activators
NPT4243	Individual protein	Cyclooxygenase-2	Rattus norvegicus	Inhibition	=	61.4	%	PMID[15780608]
NPT4248	Individual protein	Histone acetyltransferase KAT5	Homo sapiens	IC50	>	200000.0	nM	PMID[19114310]
NPT881	Individual protein	Protein kinase C delta	Homo sapiens	EC50	=	10670.0	nM	PMID[20100661]
NPT761	Individual protein	Protein kinase C epsilon	Homo sapiens	EC50	=	8810.0	nM	PMID[20100661]
NPT948	Individual protein	Carbonic anhydrase IX	Homo sapiens	Ki	=	4050.0	nM	PMID[20674354]
NPT949	Individual protein	Carbonic anhydrase XII	Homo sapiens	Ki	=	3480.0	nM	PMID[20674354]
NPT51	Individual protein	Microtubule-associated protein tau	Homo sapiens	Potency	=	28183.8	nM	PubChem BioAssay data set
NPT51	Individual protein	Microtubule-associated protein tau	Homo sapiens	Potency	=	39810.7	nM	PubChem BioAssay data set
NPT51	Individual protein	Microtubule-associated protein tau	Homo sapiens	Potency	=	7079.5	nM	PubChem BioAssay data set
NPT51	Individual protein	Microtubule-associated protein tau	Homo sapiens	Potency	=	3162.3	nM	PubChem BioAssay data set
NPT792	Individual protein	Arachidonate 15-lipoxygenase	Homo sapiens	Potency	=	15848.9	nM	PubChem BioAssay data set
NPT799	Individual protein	Intestinal alkaline phosphatase	Mus musculus	IC50	=	12000.0	nM	PubChem BioAssay data set
NPT63	Individual protein	Bromodomain adjacent to zinc finger domain protein 2B	Homo sapiens	Potency	n.a.	44668.4	nM	PubChem BioAssay data set
NPT66	Individual protein	Acetylcholinesterase	Electrophorus electricus	Inhibition	=	34.5	%	PMID[22341944]
NPT8	Individual protein	DNA polymerase iota	Homo sapiens	Potency	n.a.	19952.6	nM	PubChem BioAssay data set
NPT66	Individual protein	Acetylcholinesterase	Electrophorus electricus	IC50	>	100000.0	nM	PMID[22041172]
NPT66	Individual protein	Acetylcholinesterase	Electrophorus electricus	Inhibition	=	2.1	%	PMID[22341944]
NPT445	Individual protein	Peripheral myelin protein 22	Rattus norvegicus	Potency	n.a.	28695.4	nM	PubChem BioAssay data set
NPT478	Individual protein	Ataxin-2	Homo sapiens	Potency	n.a.	22387.2	nM	PubChem BioAssay data set
NPT755	Individual protein	Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1	Homo sapiens	Potency	n.a.	19952.6	nM	PubChem BioAssay data set
NPT66	Individual protein	Acetylcholinesterase	Electrophorus electricus	Inhibition	=	-2.21	%	PMID[23062825]
NPT861	Individual protein	Isocitrate dehydrogenase [NADP] cytoplasmic	Homo sapiens	Potency	n.a.	29092.9	nM	PubChem BioAssay data set
NPT920	Individual protein	Alpha-synuclein	Homo sapiens	Potency	n.a.	19952.6	nM	PubChem BioAssay data set
NPT66	Individual protein	Acetylcholinesterase	Electrophorus electricus	IC50	=	81050.0	nM	PMID[23583510]
NPT4260	Individual protein	11-beta-hydroxysteroid dehydrogenase 1	Rattus norvegicus	IC50	=	4125.0	nM	PMID[23800686]
NPT4260	Individual protein	11-beta-hydroxysteroid dehydrogenase 1	Rattus norvegicus	IC50	=	3921.0	nM	PMID[23800686]
NPT792	Individual protein	Arachidonate 15-lipoxygenase	Homo sapiens	IC50	=	1200.0	nM	PMID[24920381]
NPT4261	Individual protein	Lipoxygenase	Glycine max	IC50	=	59520.0	nM	PMID[24938495]
NPT4261	Individual protein	Lipoxygenase	Glycine max	Inhibition	=	68.28	%	PMID[24938495]
NPT591	Individual protein	Glycogen synthase kinase-3 beta	Homo sapiens	Thermal melting change	=	3.4	degrees C	PMID[18077363]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Ki	=	0.208	nM	PMID[17004725]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	IC50	=	800.0	nM	PMID[18793854]
NPT570	Individual protein	Arachidonate 5-lipoxygenase	Homo sapiens	IC50	=	8000.0	nM	PMID[18077363]
NPT3701	Individual protein	CpG DNA methylase	Spiroplasma monobiae	IC50	=	30.0	nM	PMID[19112019]
NPT664	Protein family	Histone deacetylase	Homo sapiens	Activity	=	52.0	%	PMID[19520580]
NPT664	Protein family	Histone deacetylase	Homo sapiens	Ki	=	539.0	nM	PMID[19520580]
NPT664	Protein family	Histone deacetylase	Homo sapiens	IC50	=	115000.0	nM	PMID[19520580]
NPT887	Individual protein	Protein kinase C theta	Homo sapiens	EC50	=	11080.0	nM	PMID[20100661]
NPT3537	Individual protein	DNA (cytosine-5)-methyltransferase 3B	Homo sapiens	Inhibition	=	80.0	%	PMID[20006515]
NPT947	Individual protein	Carbonic anhydrase I	Homo sapiens	Ki	=	2410.0	nM	PMID[20674354]
NPT954	Individual protein	Carbonic anhydrase XIV	Homo sapiens	Ki	=	11730.0	nM	PMID[20674354]
NPT197	Protein-protein interaction	Menin/Histone-lysine N-methyltransferase MLL	Homo sapiens	Potency	=	31622.8	nM	PubChem BioAssay data set
NPT197	Protein-protein interaction	Menin/Histone-lysine N-methyltransferase MLL	Homo sapiens	Potency	=	15848.9	nM	PubChem BioAssay data set
NPT197	Protein-protein interaction	Menin/Histone-lysine N-methyltransferase MLL	Homo sapiens	Potency	=	28183.8	nM	PubChem BioAssay data set
NPT197	Protein-protein interaction	Menin/Histone-lysine N-methyltransferase MLL	Homo sapiens	Potency	=	25118.9	nM	PubChem BioAssay data set
NPT197	Protein-protein interaction	Menin/Histone-lysine N-methyltransferase MLL	Homo sapiens	Potency	=	35481.3	nM	PubChem BioAssay data set
NPT45	Individual protein	Ubiquitin carboxyl-terminal hydrolase 2	Homo sapiens	Potency	=	10000.0	nM	PubChem BioAssay data set
NPT539	Individual protein	Cellular tumor antigen p53	Homo sapiens	Potency	=	15848.9	nM	PubChem BioAssay data set
NPT3704	Individual protein	Multidrug resistance protein CDR1	Candida albicans	IC50	=	14200.0	nM	PMID[19470507]
NPT3704	Individual protein	Multidrug resistance protein CDR1	Candida albicans	IC50	=	40000.0	nM	PMID[19470507]
NPT532	Individual protein	Lysine-specific demethylase 4A	Homo sapiens	Potency	n.a.	50118.7	nM	PubChem BioAssay data set
NPT539	Individual protein	Cellular tumor antigen p53	Homo sapiens	Potency	n.a.	15848.9	nM	PubChem BioAssay data set
NPT64	Individual protein	ATPase family AAA domain-containing protein 5	Homo sapiens	Potency	n.a.	25918.5	nM	PubChem BioAssay data set
NPT4253	Individual protein	Beta Lactamase	Pseudomonas aeruginosa	IC50	=	10769.0	nM	PubChem BioAssay data set
NPT4255	Individual protein	Toll-like receptor 4	Mus musculus	IC50	=	6000.0	nM	PMID[22985959]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	73.0	%	PMID[24900645]
NPT38	Individual protein	Signal transducer and activator of transcription 3	Homo sapiens	IC50	=	19250.0	nM	PMID[23434226]
NPT38	Individual protein	Signal transducer and activator of transcription 3	Homo sapiens	Inhibition	=	30.66	%	PMID[23376248]
NPT38	Individual protein	Signal transducer and activator of transcription 3	Homo sapiens	Inhibition	=	41.0	%	PMID[23434226]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	50.12	%	PMID[23511019]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	42.4	%	PMID[23685572]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	IC50	=	12350.0	nM	PMID[23799643]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	52.77	%	PMID[23799643]
NPT4259	Individual protein	11-beta-hydroxysteroid dehydrogenase 2	Rattus norvegicus	IC50	=	14939.0	nM	PMID[23800686]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	51.3	%	PMID[23932451]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	IC50	=	20300.0	nM	PMID[24095756]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	43.5	%	PMID[24095756]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	51.04	%	PMID[24148835]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	29.0	%	PMID[24594525]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	24.0	%	PMID[24594525]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	51.5	%	PMID[26337018]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	64.0	%	PMID[24589487]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	43.1	%	PMID[25778991]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	52.21	%	DOI[10.1039/C3MD00376K]
NPT570	Individual protein	Arachidonate 5-lipoxygenase	Homo sapiens	IC50	=	3900.0	nM	PMID[24920381]
NPT38	Individual protein	Signal transducer and activator of transcription 3	Homo sapiens	IC50	=	33900.0	nM	PMID[24920381]
NPT570	Individual protein	Arachidonate 5-lipoxygenase	Homo sapiens	IC50	=	500.0	nM	PMID[24920381]
NPT956	Individual protein	Prostaglandin E synthase	Homo sapiens	IC50	=	600.0	nM	PMID[24920381]
NPT956	Individual protein	Prostaglandin E synthase	Homo sapiens	IC50	=	1200.0	nM	PMID[24920381]
NPT570	Individual protein	Arachidonate 5-lipoxygenase	Homo sapiens	IC50	=	600.0	nM	PMID[24920381]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	80.0	%	PMID[25467149]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	IC50	=	11000.0	nM	PMID[25088549]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	42.3	%	PMID[26514744]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	50.2	%	PMID[25542589]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	58.0	%	PMID[25778991]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	51.8	%	PMID[25624107]
NPT22960	Single protein	Serine/threonine-protein kinase VRK1	Homo sapiens	Thermal melting change	=	1.0	degrees C	PMID[18077363]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	56.5	%	PMID[25778991]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	IC50	=	3900.0	nM	PMID[26099993]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	70.0	%	PMID[26099993]
NPT668	Individual protein	P-glycoprotein 1	Homo sapiens	IC50	=	62000.0	nM	DOI[10.1039/C4MD00196F]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	50.0	%	PMID[26288690]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	70.6	%	DOI[10.1039/C4MD00305E]
NPT78	Individual protein	Beta amyloid A4 protein	Homo sapiens	Inhibition	=	48.74	%	DOI[10.1039/C4MD00305E]

In vitro activity

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference
NPT319	Cell line	B16	Mus musculus	Inhibition	=	87.0	%	PMID[14643343]
NPT681	Cell line	PC-12	Rattus norvegicus	ED50	=	7.1	ug ml-1	PMID[11549465]
NPT744	Cell line	IMR-32	Homo sapiens	ED50	=	7.4	ug ml-1	PMID[11549465]
NPT681	Cell line	PC-12	Rattus norvegicus	ED50	=	17.1	uM	PMID[14980683]
NPT744	Cell line	IMR-32	Homo sapiens	ED50	=	23.9	uM	PMID[14980683]
NPT737	Cell line	HUVEC	Homo sapiens	IC50	=	10.84	ug.mL-1	PMID[15993583]
NPT83	Cell line	MCF7	Homo sapiens	Viability	=	64.0	%	PMID[15878268]
NPT858	Cell line	LNCaP	Homo sapiens	IC50	=	3800.0	nM	PMID[16789753]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	7700.0	nM	PMID[16789753]
NPT466	Cell line	U-937	Homo sapiens	Activity	=	17.5	%	PMID[17154519]
NPT80	Cell line	Raji	Homo sapiens	Activity	=	60.0	%	PMID[19674905]
NPT762	Cell line	A-431	Homo sapiens	ED50	=	0.75	ug ml-1	PMID[17643301]
NPT858	Cell line	LNCaP	Homo sapiens	EC50	=	35000.0	nM	PMID[17383188]
NPT306	Cell line	PC-3	Homo sapiens	Activity	=	65.0	%	PMID[17973470]
NPT306	Cell line	PC-3	Homo sapiens	Activity	=	90.0	%	PMID[17973470]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	12000.0	nM	PMID[17973470]
NPT4246	Cell line	LS174T	Homo sapiens	IC50	=	6500.0	nM	PMID[17973470]
NPT783	Cell line	MIA PaCa-2	Homo sapiens	IC50	=	9000.0	nM	PMID[17973470]
NPT1081	Cell line	BXPC-3	Homo sapiens	IC50	=	2900.0	nM	PMID[17973470]
NPT804	Cell line	HT-22	Mus musculus	Activity	=	116.0	%	PMID[17270435]
NPT137	Cell line	L1210	Mus musculus	IC50	=	9000.0	nM	PMID[17768050]
NPT404	Cell line	CCRF-CEM	Homo sapiens	IC50	=	8700.0	nM	PMID[17768050]
NPT80	Cell line	Raji	Homo sapiens	Activity	=	70.0	%	PMID[17685651]
NPT111	Cell line	K562	Homo sapiens	IC50	=	6810.0	nM	PMID[18076140]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	29300.0	nM	PMID[18039573]
NPT83	Cell line	MCF7	Homo sapiens	IC70	=	51.7	uM	PMID[18039573]
NPT4247	Cell line	MCF7R	Homo sapiens	IC50	=	26200.0	nM	PMID[18039573]
NPT4247	Cell line	MCF7R	Homo sapiens	IC70	=	46.2	uM	PMID[18039573]
NPT2891	Cell line	H4	Homo sapiens	Activity	=	59.32	%	PMID[18024584]
NPT2891	Cell line	H4	Homo sapiens	Activity	=	228.38	%	PMID[18024584]
NPT2891	Cell line	H4	Homo sapiens	Activity	=	249.22	%	PMID[18024584]
NPT91	Cell line	KB	Homo sapiens	Activity	=	89.2	%	PMID[18295490]
NPT466	Cell line	U-937	Homo sapiens	Activity	=	25.0	%	PMID[18348515]
NPT466	Cell line	U-937	Homo sapiens	Activity	=	8.5	%	PMID[18348515]
NPT466	Cell line	U-937	Homo sapiens	Activity	=	25.3	%	PMID[18348515]
NPT521	Cell line	RBL-2H3	Rattus norvegicus	Inhibition	=	62.6	%	PMID[12398545]
NPT521	Cell line	RBL-2H3	Rattus norvegicus	Inhibition	=	14.2	%	PMID[12398545]
NPT521	Cell line	RBL-2H3	Rattus norvegicus	Inhibition	=	2.0	%	PMID[12398545]
NPT521	Cell line	RBL-2H3	Rattus norvegicus	IC50	=	3000.0	nM	PMID[12398545]
NPT453	Cell line	HT-1080	Homo sapiens	ED50	=	23.4	uM	PMID[11430002]
NPT81	Cell line	A549	Homo sapiens	GC50	=	18.2	uM	PMID[18678491]
NPT81	Cell line	A549	Homo sapiens	GC50	=	73.0	uM	PMID[18678491]
NPT134	Cell line	SK-BR-3	Homo sapiens	IC50	=	2110.0	nM	PMID[19019687]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	5580.0	nM	PMID[19019687]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	19800.0	nM	PMID[19249204]
NPT858	Cell line	LNCaP	Homo sapiens	IC50	=	19600.0	nM	PMID[19249204]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	21500.0	nM	PMID[19249204]
NPT82	Cell line	MDA-MB-231	Homo sapiens	IC50	=	25600.0	nM	PMID[19249204]
NPT377	Cell line	OVCAR-3	Homo sapiens	CD50	=	4.4	ug ml-1	PMID[9868158]
NPT80	Cell line	Raji	Homo sapiens	Activity	>	80.0	%	PMID[19481937]
NPT547	Cell line	BGC-823	Homo sapiens	IC50	=	16700.0	nM	PMID[19243951]
NPT3887	Cell line	CNE	Homo sapiens	IC50	=	32800.0	nM	PMID[19243951]
NPT91	Cell line	KB	Homo sapiens	IC50	=	11600.0	nM	PMID[19243951]
NPT116	Cell line	HL-60	Homo sapiens	IC50	=	35900.0	nM	PMID[19243951]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	15000.0	nM	PMID[19243951]
NPT165	Cell line	HeLa	Homo sapiens	IC50	=	17500.0	nM	PMID[19243951]
NPT1719	Cell line	2008	Homo sapiens	Activity	>	90.0	%	PMID[19329324]
NPT189	Cell line	Vero	Chlorocebus aethiops	Activity	>	25.0	%	PMID[19329324]
NPT189	Cell line	Vero	Chlorocebus aethiops	Activity	=	10.0	%	PMID[19329324]
NPT1719	Cell line	2008	Homo sapiens	IC50	=	5000.0	nM	PMID[19329324]
NPT189	Cell line	Vero	Chlorocebus aethiops	Ratio IC50	=	1.3	n.a.	PMID[19329324]
NPT1719	Cell line	2008	Homo sapiens	Ratio IC50	=	3.4	n.a.	PMID[19329324]
NPT189	Cell line	Vero	Chlorocebus aethiops	IC50	=	22000.0	nM	PMID[19329324]
NPT1649	Cell line	MV4-11	Homo sapiens	Activity	=	15.0	%	PMID[19112019]
NPT681	Cell line	PC-12	Rattus norvegicus	ED50	=	7.0	ug ml-1	PMID[12350137]
NPT681	Cell line	PC-12	Rattus norvegicus	ED50	=	10.0	ug ml-1	PMID[12350137]
NPT91	Cell line	KB	Homo sapiens	IC50	=	5.5	ug.mL-1	PMID[17067159]
NPT91	Cell line	KB	Homo sapiens	IC50	=	3.1	ug.mL-1	PMID[17067159]
NPT81	Cell line	A549	Homo sapiens	IC50	=	5.2	ug.mL-1	PMID[17067159]
NPT116	Cell line	HL-60	Homo sapiens	IC50	=	34220.0	nM	PMID[16038556]
NPT65	Cell line	HepG2	Homo sapiens	IC50	=	35530.0	nM	PMID[16038556]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	10440.0	nM	PMID[16038556]
NPT90	Cell line	DU-145	Homo sapiens	IC50	=	20600.0	nM	PMID[16038556]
NPT397	Cell line	NCI-H460	Homo sapiens	IC50	=	27600.0	nM	PMID[16038556]
NPT189	Cell line	Vero	Chlorocebus aethiops	Inhibition	=	10.0	%	PMID[18439726]
NPT189	Cell line	Vero	Chlorocebus aethiops	Inhibition	=	20.0	%	PMID[18439726]
NPT858	Cell line	LNCaP	Homo sapiens	IC50	=	8500.0	nM	PMID[19725582]
NPT1629	Cell line	CWR22R	Homo sapiens	IC50	=	18300.0	nM	PMID[19725582]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	16800.0	nM	PMID[19725582]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	20380.0	nM	PMID[19359068]
NPT81	Cell line	A549	Homo sapiens	IC50	=	13000.0	nM	PMID[19854644]
NPT1460	Cell line	L929	Mus musculus	Inhibition	=	25.0	%	PMID[19775895]
NPT1460	Cell line	L929	Mus musculus	Inhibition	=	47.0	%	PMID[19775895]
NPT1460	Cell line	L929	Mus musculus	Inhibition	=	52.0	%	PMID[19775895]
NPT1460	Cell line	L929	Mus musculus	IC50	=	20000.0	nM	PMID[19775895]
NPT737	Cell line	HUVEC	Homo sapiens	Inhibition	=	90.0	%	PMID[19674910]
NPT737	Cell line	HUVEC	Homo sapiens	MTD	=	50.0	uM/ml	PMID[19674910]
NPT579	Cell line	DLD-1	Homo sapiens	GI50	=	8000.0	nM	PMID[20060305]
NPT71	Cell line	HEK293	Homo sapiens	EC50	=	37000.0	nM	PMID[20004045]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	8300.0	nM	PMID[19778086]
NPT848	Cell line	N9	Homo sapiens	Inhibition	=	86.6	%	PMID[19691309]
NPT848	Cell line	N9	Homo sapiens	Inhibition	=	75.6	%	PMID[19691309]
NPT848	Cell line	N9	Homo sapiens	Inhibition	=	56.1	%	PMID[19691309]
NPT848	Cell line	N9	Homo sapiens	Inhibition	=	35.2	%	PMID[19691309]
NPT848	Cell line	N9	Homo sapiens	IC50	=	13500.0	nM	PMID[19691309]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	51500.0	nM	PMID[20297825]
NPT65	Cell line	HepG2	Homo sapiens	IC50	=	43800.0	nM	PMID[20297825]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	22700.0	nM	PMID[20297825]
NPT492	Cell line	Caco-2	Homo sapiens	IC50	=	48600.0	nM	PMID[20297825]
NPT114	Cell line	LoVo	Homo sapiens	IC50	=	24000.0	nM	PMID[20466556]
NPT1125	Cell line	T98G	Homo sapiens	IC50	=	25000.0	nM	PMID[20466556]
NPT169	Cell line	B16-F10	Mus musculus	IC50	=	10000.0	nM	PMID[20466556]
NPT2337	Cell line	OE33	Homo sapiens	IC50	=	35000.0	nM	PMID[20466556]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	33000.0	nM	PMID[20466556]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	24000.0	nM	PMID[20466556]
NPT81	Cell line	A549	Homo sapiens	IC50	=	27000.0	nM	PMID[20466556]
NPT1970	Cell line	THP-1	Homo sapiens	IC50	=	1210.0	nM	PMID[20561785]
NPT82	Cell line	MDA-MB-231	Homo sapiens	EC50	=	7600.0	nM	PMID[20728364]
NPT784	Cell line	MDA-MB-468	Homo sapiens	EC50	=	9700.0	nM	PMID[20728364]
NPT134	Cell line	SK-BR-3	Homo sapiens	IC50	=	2400.0	nM	PMID[20728364]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	24460.0	nM	PMID[20805034]
NPT83	Cell line	MCF7	Homo sapiens	FC	=	4.0	n.a.	PMID[20805034]
NPT492	Cell line	Caco-2	Homo sapiens	IC50	=	15000.0	nM	PMID[20831222]
NPT519	Cell line	SH-SY5Y	Homo sapiens	IC50	=	12800.0	nM	PMID[20831222]
NPT76	Cell line	C6	Rattus norvegicus	IC50	=	16100.0	nM	PMID[20831222]
NPT941	Cell line	HaCaT	Homo sapiens	IC50	=	21900.0	nM	PMID[20831222]
NPT886	Cell line	NIH3T3	Mus musculus	IC50	=	14200.0	nM	PMID[20831222]
NPT113	Cell line	RAW264.7	Mus musculus	Inhibition	=	35.6	%	PMID[20934787]
NPT113	Cell line	RAW264.7	Mus musculus	Inhibition	=	75.7	%	PMID[20934787]
NPT323	Cell line	SW-620	Homo sapiens	GI50	=	32000.0	nM	PMID[21183341]
NPT762	Cell line	A-431	Homo sapiens	IC50	=	13800.0	nM	PMID[21215629]
NPT380	Cell line	U-251	Homo sapiens	IC50	=	13800.0	nM	PMID[21215629]
NPT165	Cell line	HeLa	Homo sapiens	IC50	=	27400.0	nM	PMID[21215629]
NPT65	Cell line	HepG2	Homo sapiens	IC50	=	31600.0	nM	PMID[21215629]
NPT146	Cell line	SK-OV-3	Homo sapiens	IC50	=	37700.0	nM	PMID[21215629]
NPT81	Cell line	A549	Homo sapiens	IC50	=	42600.0	nM	PMID[21215629]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	48000.0	nM	PMID[21215629]
NPT1171	Cell line	HEp-2	Homo sapiens	IC50	=	56900.0	nM	PMID[21215629]
NPT1083	Cell line	A-375	Homo sapiens	Activity	=	3.4	%	PMID[21188975]
NPT1083	Cell line	A-375	Homo sapiens	Activity	=	10.3	%	PMID[21188975]
NPT1083	Cell line	A-375	Homo sapiens	Activity	=	30.5	%	PMID[21188975]
NPT927	Cell line	PBMC	Homo sapiens	IC50	=	2.71	ug.mL-1	PMID[21600765]
NPT397	Cell line	NCI-H460	Homo sapiens	IC50	=	20290.0	nM	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	70.0	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	12.02	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	87.91	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	7.97	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	3.66	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	0.46	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	89.15	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	8.57	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	2.06	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	0.23	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	83.6	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	4.06	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	Activity	=	0.32	%	PMID[21504179]
NPT397	Cell line	NCI-H460	Homo sapiens	GI50	=	16700.0	nM	PMID[21514701]
NPT397	Cell line	NCI-H460	Homo sapiens	TGI	=	50100.0	nM	PMID[21514701]
NPT83	Cell line	MCF7	Homo sapiens	GI50	=	4700.0	nM	PMID[21514701]
NPT83	Cell line	MCF7	Homo sapiens	TGI	=	8300.0	nM	PMID[21514701]
NPT395	Cell line	SF-268	Homo sapiens	GI50	=	5100.0	nM	PMID[21514701]
NPT395	Cell line	SF-268	Homo sapiens	TGI	=	9200.0	nM	PMID[21514701]
NPT81	Cell line	A549	Homo sapiens	GI50	=	15230.0	nM	PMID[21070043]
NPT81	Cell line	A549	Homo sapiens	GI50	=	9440.0	nM	PMID[21070043]
NPT397	Cell line	NCI-H460	Homo sapiens	GI50	=	12130.0	nM	PMID[21070043]
NPT1668	Cell line	NCI-H157	Homo sapiens	GI50	=	19250.0	nM	PMID[21070043]
NPT81	Cell line	A549	Homo sapiens	Activity	=	16.0	%	PMID[21830815]
NPT165	Cell line	HeLa	Homo sapiens	Activity	=	8.0	%	PMID[21830815]
NPT81	Cell line	A549	Homo sapiens	IC50	=	17000.0	nM	PMID[21830815]
NPT165	Cell line	HeLa	Homo sapiens	IC50	=	18000.0	nM	PMID[25577711]
NPT165	Cell line	HeLa	Homo sapiens	Activity	=	18.0	%	PMID[21830815]
NPT1161	Cell line	CHO	Cricetulus griseus	IC50	=	34611.0	nM	PubChem BioAssay data set
NPT179	Cell line	A2780	Homo sapiens	IC50	=	38000.0	nM	PMID[22029378]
NPT179	Cell line	A2780	Homo sapiens	IC50	=	12000.0	nM	PMID[22029378]
NPT179	Cell line	A2780	Homo sapiens	IC50	=	8000.0	nM	PMID[22029378]
NPT179	Cell line	A2780	Homo sapiens	IC50	=	28000.0	nM	PMID[22029378]
NPT179	Cell line	A2780	Homo sapiens	IC50	=	18000.0	nM	PMID[22029378]
NPT179	Cell line	A2780	Homo sapiens	IC50	=	11000.0	nM	PMID[22029378]
NPT393	Cell line	HCT-116	Homo sapiens	IC50	=	13000.0	nM	PMID[22029378]
NPT393	Cell line	HCT-116	Homo sapiens	IC50	=	4000.0	nM	PMID[22029378]
NPT114	Cell line	LoVo	Homo sapiens	IC50	=	16000.0	nM	PMID[22029378]
NPT114	Cell line	LoVo	Homo sapiens	IC50	=	10000.0	nM	PMID[22029378]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	49800.0	nM	PMID[22222040]
NPT519	Cell line	SH-SY5Y	Homo sapiens	IC50	=	105000.0	nM	PMID[22222040]
NPT65	Cell line	HepG2	Homo sapiens	IC50	=	87500.0	nM	PMID[22222040]
NPT397	Cell line	NCI-H460	Homo sapiens	IC50	=	51300.0	nM	PMID[22222040]
NPT393	Cell line	HCT-116	Homo sapiens	Activity	=	48.97	%	PMID[22409967]
NPT393	Cell line	HCT-116	Homo sapiens	Activity	=	5.62	%	PMID[22409967]
NPT393	Cell line	HCT-116	Homo sapiens	Activity	=	45.42	%	PMID[22409967]
NPT65	Cell line	HepG2	Homo sapiens	IC50	=	50000000.0	nM	PMID[23685942]
NPT393	Cell line	HCT-116	Homo sapiens	IC50	=	50000000.0	nM	PMID[23685942]
NPT3558	Cell line	QG-56	n.a.	IC50	=	100000000.0	nM	PMID[23685942]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	19370.0	nM	PMID[22551677]
NPT461	Cell line	PANC-1	Homo sapiens	IC50	=	23680.0	nM	PMID[22551677]
NPT139	Cell line	HT-29	Homo sapiens	IC50	=	18740.0	nM	PMID[22551677]
NPT858	Cell line	LNCaP	Homo sapiens	IC50	=	36400.0	nM	PMID[22672984]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	36000.0	nM	PMID[22672984]
NPT81	Cell line	A549	Homo sapiens	IC50	=	62590.0	nM	PMID[22546674]
NPT90	Cell line	DU-145	Homo sapiens	IC50	=	38170.0	nM	PMID[22546674]
NPT373	Cell line	SK-MEL-5	Homo sapiens	IC50	=	50370.0	nM	PMID[22546674]
NPT1081	Cell line	BXPC-3	Homo sapiens	IC50	=	11430.0	nM	PMID[22546674]
NPT65	Cell line	HepG2	Homo sapiens	IC50	=	59370.0	nM	PMID[22546674]
NPT139	Cell line	HT-29	Homo sapiens	IC50	=	15900.0	nM	PMID[22546674]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	65160.0	nM	PMID[22546674]
NPT82	Cell line	MDA-MB-231	Homo sapiens	IC50	=	64670.0	nM	PMID[22546674]
NPT81	Cell line	A549	Homo sapiens	IC50	=	11580.0	nM	PMID[22889562]
NPT660	Cell line	SW480	Homo sapiens	IC50	=	10170.0	nM	PMID[22889562]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	15660.0	nM	PMID[22889562]
NPT65	Cell line	HepG2	Homo sapiens	IC50	=	20690.0	nM	PMID[22889562]
NPT82	Cell line	MDA-MB-231	Homo sapiens	IC50	=	37800.0	nM	PMID[23153397]
NPT65	Cell line	HepG2	Homo sapiens	IC50	=	31300.0	nM	PMID[23153397]
NPT81	Cell line	A549	Homo sapiens	IC50	=	49200.0	nM	PMID[23153397]
NPT139	Cell line	HT-29	Homo sapiens	GI	=	70.0	%	PMID[23245566]
NPT139	Cell line	HT-29	Homo sapiens	Activity	=	45.0	%	PMID[23245566]
NPT139	Cell line	HT-29	Homo sapiens	Activity	=	84.0	%	PMID[23245566]
NPT393	Cell line	HCT-116	Homo sapiens	Activity	=	22.4	%	DOI[10.1007/s00044-011-9851-6]
NPT393	Cell line	HCT-116	Homo sapiens	Activity	=	49.6	%	DOI[10.1007/s00044-011-9851-6]
NPT393	Cell line	HCT-116	Homo sapiens	Activity	=	61.6	%	DOI[10.1007/s00044-011-9851-6]
NPT134	Cell line	SK-BR-3	Homo sapiens	Activity	=	56.5	%	DOI[10.1007/s00044-011-9851-6]
NPT134	Cell line	SK-BR-3	Homo sapiens	Activity	=	74.0	%	DOI[10.1007/s00044-011-9851-6]
NPT134	Cell line	SK-BR-3	Homo sapiens	Activity	=	53.7	%	DOI[10.1007/s00044-011-9851-6]
NPT165	Cell line	HeLa	Homo sapiens	Activity	=	28.0	%	DOI[10.1007/s00044-011-9851-6]
NPT165	Cell line	HeLa	Homo sapiens	Activity	=	53.7	%	DOI[10.1007/s00044-011-9851-6]
NPT165	Cell line	HeLa	Homo sapiens	Activity	=	78.3	%	DOI[10.1007/s00044-011-9851-6]
NPT393	Cell line	HCT-116	Homo sapiens	IC50	=	10000.0	nM	DOI[10.1007/s00044-011-9851-6]
NPT134	Cell line	SK-BR-3	Homo sapiens	IC50	=	27000.0	nM	DOI[10.1007/s00044-011-9851-6]
NPT165	Cell line	HeLa	Homo sapiens	IC50	=	17000.0	nM	DOI[10.1007/s00044-013-0510-y]
NPT1083	Cell line	A-375	Homo sapiens	Activity	=	50.2	%	DOI[10.1007/s00044-011-9851-6]
NPT1083	Cell line	A-375	Homo sapiens	Activity	=	72.3	%	DOI[10.1007/s00044-011-9851-6]
NPT1083	Cell line	A-375	Homo sapiens	Activity	=	92.0	%	DOI[10.1007/s00044-011-9851-6]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	21580.0	nM	DOI[10.1007/s00044-010-9521-0]
NPT660	Cell line	SW480	Homo sapiens	IC50	=	18130.0	nM	DOI[10.1007/s00044-010-9353-y]
NPT81	Cell line	A549	Homo sapiens	IC50	=	24590.0	nM	DOI[10.1007/s00044-010-9353-y]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	21390.0	nM	DOI[10.1007/s00044-010-9353-y]
NPT165	Cell line	HeLa	Homo sapiens	IC50	=	17310.0	nM	DOI[10.1007/s00044-010-9353-y]
NPT111	Cell line	K562	Homo sapiens	IC50	=	54300.0	nM	DOI[10.1007/s00044-010-9344-z]
NPT682	Cell line	SK-N-MC	Homo sapiens	IC50	=	57400.0	nM	DOI[10.1007/s00044-010-9344-z]
NPT111	Cell line	K562	Homo sapiens	IC50	=	49200.0	nM	DOI[10.1007/s00044-010-9344-z]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	12000.0	nM	DOI[10.1007/s00044-010-9344-z]
NPT165	Cell line	HeLa	Homo sapiens	IC50	=	13800.0	nM	DOI[10.1007/s00044-010-9344-z]
NPT457	Cell line	BT-549	Homo sapiens	IC50	=	10500.0	nM	DOI[10.1007/s00044-011-9587-3]
NPT91	Cell line	KB	Homo sapiens	IC50	>	25000.0	nM	DOI[10.1007/s00044-011-9587-3]
NPT916	Cell line	SK-MEL	Homo sapiens	IC50	=	13750.0	nM	DOI[10.1007/s00044-011-9587-3]
NPT83	Cell line	MCF7	Homo sapiens	Activity	=	19.0	%	DOI[10.1007/s00044-012-0116-9]
NPT189	Cell line	Vero	Chlorocebus aethiops	Activity	=	24.0	%	DOI[10.1007/s00044-012-0116-9]
NPT1374	Cell line	WI-38	Homo sapiens	Activity	=	51.0	%	DOI[10.1007/s00044-012-0116-9]
NPT65	Cell line	HepG2	Homo sapiens	Activity	=	18.0	%	DOI[10.1007/s00044-012-0116-9]
NPT81	Cell line	A549	Homo sapiens	IC50	=	22000.0	nM	DOI[10.1007/s00044-013-0510-y]
NPT65	Cell line	HepG2	Homo sapiens	IC50	=	16000.0	nM	DOI[10.1007/s00044-013-0510-y]
NPT762	Cell line	A-431	Homo sapiens	IC50	=	22000.0	nM	DOI[10.1007/s00044-013-0510-y]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	26000.0	nM	DOI[10.1007/s00044-013-0510-y]
NPT65	Cell line	HepG2	Homo sapiens	IC50	=	26990.0	nM	PMID[23245570]
NPT784	Cell line	MDA-MB-468	Homo sapiens	IC50	=	196500.0	nM	PMID[23434226]
NPT784	Cell line	MDA-MB-468	Homo sapiens	Inhibition	=	3.88	%	PMID[23434226]
NPT165	Cell line	HeLa	Homo sapiens	FC	=	1.4	n.a.	PMID[23524113]
NPT165	Cell line	HeLa	Homo sapiens	FC	=	1.7	n.a.	PMID[23524113]
NPT165	Cell line	HeLa	Homo sapiens	FC	=	2.1	n.a.	PMID[23524113]
NPT34	Cell line	BV-2	Mus musculus	IC50	=	3100.0	nM	PMID[23734721]
NPT165	Cell line	HeLa	Homo sapiens	IC50	=	50000000.0	nM	PMID[23685942]
NPT139	Cell line	HT-29	Homo sapiens	IC50	=	13200.0	nM	PMID[23644215]
NPT393	Cell line	HCT-116	Homo sapiens	IC50	=	11540.0	nM	PMID[23644215]
NPT139	Cell line	HT-29	Homo sapiens	Ratio IC50	=	0.48	n.a.	PMID[23644215]
NPT393	Cell line	HCT-116	Homo sapiens	Ratio IC50	=	0.39	n.a.	PMID[23644215]
NPT65	Cell line	HepG2	Homo sapiens	Activity	=	50.2	%	PMID[23357628]
NPT65	Cell line	HepG2	Homo sapiens	Activity	=	29.33	%	PMID[23357628]
NPT65	Cell line	HepG2	Homo sapiens	Activity	=	20.46	%	PMID[23357628]
NPT393	Cell line	HCT-116	Homo sapiens	IC50	=	41500.0	nM	PMID[23357628]
NPT81	Cell line	A549	Homo sapiens	IC50	=	32200.0	nM	PMID[23357628]
NPT515	Cell line	SGC-7901	Homo sapiens	IC50	=	29000.0	nM	PMID[23357628]
NPT65	Cell line	HepG2	Homo sapiens	IC50	=	78700.0	nM	PMID[23357628]
NPT82	Cell line	MDA-MB-231	Homo sapiens	IC50	=	24000.0	nM	PMID[23145932]
NPT82	Cell line	MDA-MB-231	Homo sapiens	MEC	=	13.0	uM	PMID[23145932]
NPT82	Cell line	MDA-MB-231	Homo sapiens	Inhibition	>	50.0	%	PMID[23145932]
NPT82	Cell line	MDA-MB-231	Homo sapiens	Inhibition	=	48.0	%	PMID[23145932]
NPT82	Cell line	MDA-MB-231	Homo sapiens	Inhibition	=	53.0	%	PMID[23145932]
NPT82	Cell line	MDA-MB-231	Homo sapiens	Inhibition	=	57.0	%	PMID[23145932]
NPT82	Cell line	MDA-MB-231	Homo sapiens	Inhibition	=	51.0	%	PMID[23145932]
NPT82	Cell line	MDA-MB-231	Homo sapiens	MTC	=	82.0	uM	PMID[23145932]
NPT2489	Cell line	MeWo	Homo sapiens	IC50	=	35500.0	nM	PMID[23830698]
NPT2489	Cell line	MeWo	Homo sapiens	Activity	=	90.0	%	PMID[23830698]
NPT1970	Cell line	THP-1	Homo sapiens	FC	=	1.8	n.a.	PMID[23933533]
NPT1970	Cell line	THP-1	Homo sapiens	FC	=	1.5	n.a.	PMID[23933533]
NPT1970	Cell line	THP-1	Homo sapiens	FC	=	0.9	n.a.	PMID[23933533]
NPT1970	Cell line	THP-1	Homo sapiens	FC	=	0.5	n.a.	PMID[23933533]
NPT1970	Cell line	THP-1	Homo sapiens	Inhibition	=	1.5	%	PMID[23933533]
NPT1970	Cell line	THP-1	Homo sapiens	Inhibition	=	38.0	%	PMID[23933533]
NPT1970	Cell line	THP-1	Homo sapiens	Inhibition	=	95.5	%	PMID[23933533]
NPT1970	Cell line	THP-1	Homo sapiens	Inhibition	=	102.5	%	PMID[23933533]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	5000.0	nM	PMID[24094143]
NPT2028	Cell line	SK-N-FI	Homo sapiens	IC50	=	11300.0	nM	PMID[24183537]
NPT136	Cell line	SK-N-SH	Homo sapiens	IC50	=	6400.0	nM	PMID[24183537]
NPT737	Cell line	HUVEC	Homo sapiens	Inhibition	=	45.0	%	PMID[24332631]
NPT1045	Cell line	U2OS	Homo sapiens	Activity	=	34.8	%	PMID[24275249]
NPT1045	Cell line	U2OS	Homo sapiens	Activity	=	42.4	%	PMID[24275249]
NPT1045	Cell line	U2OS	Homo sapiens	Activity	=	29.0	%	PMID[24275249]
NPT113	Cell line	RAW264.7	Mus musculus	Inhibition	=	20.0	%	PMID[24321865]
NPT81	Cell line	A549	Homo sapiens	IC50	=	15000.0	nM	PMID[24531225]
NPT165	Cell line	HeLa	Homo sapiens	IC50	=	12600.0	nM	PMID[24531225]
NPT82	Cell line	MDA-MB-231	Homo sapiens	IC50	=	880.0	nM	PMID[24531225]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	1980.0	nM	PMID[24531225]
NPT90	Cell line	DU-145	Homo sapiens	IC50	=	300.0	nM	PMID[24531225]
NPT2132	Cell line	EOL1	Homo sapiens	Inhibition	=	37.0	%	PMID[24689857]
NPT2132	Cell line	EOL1	Homo sapiens	Inhibition	=	33.0	%	PMID[24689857]
NPT2132	Cell line	EOL1	Homo sapiens	Inhibition	=	12.0	%	PMID[24689857]
NPT2132	Cell line	EOL1	Homo sapiens	Inhibition	=	17.0	%	PMID[24689857]
NPT2132	Cell line	EOL1	Homo sapiens	Inhibition	=	70.0	%	PMID[24689857]
NPT2132	Cell line	EOL1	Homo sapiens	Inhibition	=	13.0	%	PMID[24689857]
NPT2132	Cell line	EOL1	Homo sapiens	Inhibition	=	44.0	%	PMID[24689857]
NPT2132	Cell line	EOL1	Homo sapiens	Inhibition	=	82.0	%	PMID[24689857]
NPT34	Cell line	BV-2	Mus musculus	IC50	=	500.0	nM	PMID[24593150]
NPT858	Cell line	LNCaP	Homo sapiens	IC50	=	36000.0	nM	PMID[24920381]
NPT927	Cell line	PBMC	Homo sapiens	IC50	=	34800.0	nM	PMID[24920381]
NPT91	Cell line	KB	Homo sapiens	IC50	=	21360.0	nM	PMID[24857542]
NPT189	Cell line	Vero	Chlorocebus aethiops	IC50	=	35050.0	nM	PMID[24857542]
NPT189	Cell line	Vero	Chlorocebus aethiops	Ratio IC50	=	1.64	n.a.	PMID[24857542]
NPT82	Cell line	MDA-MB-231	Homo sapiens	IC50	=	34400.0	nM	PMID[25453798]
NPT113	Cell line	RAW264.7	Mus musculus	Inhibition	=	77.04	%	PMID[25453803]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	6200.0	nM	PMID[25453803]
NPT2678	Cell line	NB-4	Homo sapiens	log2FC	=	3.304	n.a.	PMID[24960549]
NPT2678	Cell line	NB-4	Homo sapiens	log2FC	=	3.765	n.a.	PMID[24960549]
NPT2678	Cell line	NB-4	Homo sapiens	log2FC	=	3.209	n.a.	PMID[24960549]
NPT2678	Cell line	NB-4	Homo sapiens	log2FC	=	2.746	n.a.	PMID[24960549]
NPT2678	Cell line	NB-4	Homo sapiens	log2FC	=	2.927	n.a.	PMID[24960549]
NPT2678	Cell line	NB-4	Homo sapiens	log2FC	=	2.66	n.a.	PMID[24960549]
NPT858	Cell line	LNCaP	Homo sapiens	Ratio	=	2.0	n.a.	PMID[24961640]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	11020.0	nM	PMID[25824662]
NPT1182	Cell line	J774.A1	Mus musculus	IC50	=	18520.0	nM	PMID[25113933]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	1.25	ug.mL-1	PMID[25113933]
NPT1182	Cell line	J774.A1	Mus musculus	IC50	=	2.08	ug.mL-1	PMID[25113933]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	6.44	ug.mL-1	PMID[25113933]
NPT1182	Cell line	J774.A1	Mus musculus	IC50	=	24.82	ug.mL-1	PMID[25113933]
NPT113	Cell line	RAW264.7	Mus musculus	Inhibition	=	1.25	%	PMID[24909081]
NPT113	Cell line	RAW264.7	Mus musculus	Inhibition	=	6.44	%	PMID[24909081]
NPT333	Cell line	CEM	Homo sapiens	IC50	=	8160.0	nM	PMID[24657568]
NPT165	Cell line	HeLa	Homo sapiens	IC50	=	21200.0	nM	PMID[24657568]
NPT137	Cell line	L1210	Mus musculus	IC50	=	15100.0	nM	PMID[24657568]
NPT804	Cell line	HT-22	Mus musculus	Inhibition	=	36.0	%	PMID[25313922]
NPT804	Cell line	HT-22	Mus musculus	Inhibition	=	18.0	%	PMID[25313922]
NPT333	Cell line	CEM	Homo sapiens	IC50	=	15000.0	nM	PMID[25577711]
NPT137	Cell line	L1210	Mus musculus	IC50	=	22000.0	nM	PMID[25577711]
NPT1374	Cell line	WI-38	Homo sapiens	Inhibition	=	98.7	%	PMID[25577711]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	3400.0	nM	PMID[25824662]
NPT1182	Cell line	J774.A1	Mus musculus	IC50	=	5600.0	nM	PMID[25824662]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	17500.0	nM	PMID[25824662]
NPT1182	Cell line	J774.A1	Mus musculus	IC50	=	67400.0	nM	PMID[25824662]
NPT927	Cell line	PBMC	Homo sapiens	IC50	=	12.3	ug.mL-1	PMID[25881826]
NPT407	Cell line	COLO 205	Homo sapiens	Activity	=	20.7	%	PMID[25881826]
NPT407	Cell line	COLO 205	Homo sapiens	Activity	=	23.0	%	PMID[25881826]
NPT407	Cell line	COLO 205	Homo sapiens	Activity	=	23.3	%	PMID[25881826]
NPT83	Cell line	MCF7	Homo sapiens	IC50	=	70200.0	nM	PMID[25728027]
NPT306	Cell line	PC-3	Homo sapiens	Inhibition	=	2.45	%	PMID[25961334]
NPT306	Cell line	PC-3	Homo sapiens	Inhibition	=	55.07	%	PMID[25961334]
NPT90	Cell line	DU-145	Homo sapiens	Inhibition	=	58.49	%	PMID[25961334]
NPT90	Cell line	DU-145	Homo sapiens	Inhibition	=	7.25	%	PMID[25961334]
NPT858	Cell line	LNCaP	Homo sapiens	Inhibition	=	65.45	%	PMID[25961334]
NPT858	Cell line	LNCaP	Homo sapiens	Inhibition	=	28.78	%	PMID[25961334]
NPT165	Cell line	HeLa	Homo sapiens	Inhibition	=	50.3	%	PMID[25961334]
NPT165	Cell line	HeLa	Homo sapiens	Inhibition	=	13.75	%	PMID[25961334]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	25430.0	nM	PMID[25961334]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	12360.0	nM	PMID[25961334]
NPT90	Cell line	DU-145	Homo sapiens	IC50	=	26230.0	nM	PMID[25961334]
NPT858	Cell line	LNCaP	Homo sapiens	IC50	=	13610.0	nM	PMID[25961334]
NPT165	Cell line	HeLa	Homo sapiens	IC50	=	12110.0	nM	PMID[25961334]
NPT165	Cell line	HeLa	Homo sapiens	IC50	=	10460.0	nM	PMID[25961334]
NPT306	Cell line	PC-3	Homo sapiens	Ratio IC50	=	1.0	n.a.	PMID[25961334]
NPT90	Cell line	DU-145	Homo sapiens	Ratio IC50	=	1.0	n.a.	PMID[25961334]
NPT858	Cell line	LNCaP	Homo sapiens	Ratio IC50	=	1.0	n.a.	PMID[25961334]
NPT165	Cell line	HeLa	Homo sapiens	Ratio IC50	=	1.0	n.a.	PMID[25961334]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	22910.0	nM	PMID[26048786]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	14700.0	nM	PMID[26071636]
NPT113	Cell line	RAW264.7	Mus musculus	Inhibition	=	99.3	%	PMID[26071636]
NPT113	Cell line	RAW264.7	Mus musculus	IC50	=	28800.0	nM	PMID[26071636]
NPT90	Cell line	DU-145	Homo sapiens	IC50	=	26200.0	nM	PMID[26341135]
NPT306	Cell line	PC-3	Homo sapiens	IC50	=	25400.0	nM	PMID[26341135]
NPT858	Cell line	LNCaP	Homo sapiens	IC50	=	12100.0	nM	PMID[26341135]
NPT519	Cell line	SH-SY5Y	Homo sapiens	Inhibition	=	37.87	%	DOI[10.1039/C4MD00305E]
NPT82	Cell line	MDA-MB-231	Homo sapiens	IC50	=	15000.0	nM	PMID[26561365]
NPT3722	Cell line	4T1	Mus musculus	IC50	=	20000.0	nM	PMID[26561365]
NPT25	Cell line	MT4	Homo sapiens	CC50	=	7400.0	nM	PMID[9767632]
NPT91	Cell line	KB	Homo sapiens	CC50	=	16000.0	nM	PMID[9767632]
NPT189	Cell line	Vero	Chlorocebus aethiops	CC50	>	250000.0	nM	PMID[17663539]
NPT165	Cell line	HeLa	Homo sapiens	CC50	>=	10.0	nM	PMID[20034711]
NPT2192	Cell line	HEL	Homo sapiens	CC50	>=	10.0	nM	PMID[20034711]
NPT2192	Cell line	HEL	Homo sapiens	CC50	>	2.0	nM	PMID[20034711]
NPT189	Cell line	Vero	Chlorocebus aethiops	CC50	=	54.0	nM	PMID[20034711]
NPT616	Cell line	MDCK	Canis lupus familiaris	CC50	>	92.0	nM	PMID[20034711]
NPT25	Cell line	MT4	Homo sapiens	CC50	>	37.0	nM	PMID[20034711]
NPT189	Cell line	Vero	Chlorocebus aethiops	CC50	n.a.	19880.0	nM	PubChem BioAssay data set
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC50	=	24690.0	nM	PMID[17145789]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC90	=	44450.0	nM	PMID[17145789]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC50	=	22930.0	nM	PMID[17145789]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC90	=	41270.0	nM	PMID[17145789]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC50	=	27450.0	nM	PMID[17145789]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC90	=	49420.0	nM	PMID[17145789]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC50	=	29610.0	nM	PMID[17145789]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC90	=	53290.0	nM	PMID[17145789]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC50	=	3250.0	nM	PMID[18194869]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	MIC	=	13200.0	nM	PMID[18194869]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	MIC	=	14400.0	nM	PMID[18194869]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC50	=	4210.0	nM	PMID[18194869]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC50	=	15000.0	nM	PMID[19329310]
NPT335	Organism	Human coxsackievirus B4	Human coxsackievirus B4	EC50	>	10.0	nM	PMID[20034711]
NPT341	Organism	Punta Toro virus	Punta Toro virus	EC50	>	10.0	nM	PMID[20034711]
NPT342	Organism	Feline coronavirus	Feline coronavirus	EC50	>	271.0	nM	PMID[20034711]
NPT843	Organism	Trypanosoma evansi	Trypanosoma evansi	EC50	=	2000.0	nM	PMID[20004045]
NPT172	Organism	Proteus mirabilis	Proteus mirabilis	MIC	=	1230.0	nM	PMID[20034711]
NPT70	Organism	Respiratory syncytial virus	Respiratory syncytial virus	EC50	>	10.0	nM	PMID[20034711]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC50	=	4.2	ug.mL-1	PMID[19299148]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	IC50	=	3.5	ug.mL-1	PMID[19299148]
NPT115	Organism	Mycobacterium tuberculosis H37Ra	Mycobacterium tuberculosis H37Ra	MIC	=	100.0	ug.mL-1	PMID[20691508]
NPT451	Organism	Helicobacter pylori	Helicobacter pylori	MIC	=	5.0	ug.mL-1	PMID[19204190]
NPT451	Organism	Helicobacter pylori	Helicobacter pylori	MIC	=	15.0	ug.mL-1	PMID[19204190]
NPT451	Organism	Helicobacter pylori	Helicobacter pylori	MIC	=	50.0	ug.mL-1	PMID[19204190]
NPT451	Organism	Helicobacter pylori	Helicobacter pylori	MIC	=	30.0	ug.mL-1	PMID[19204190]
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	Potency	n.a.	19011.5	nM	PubChem BioAssay data set
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	Potency	n.a.	2078.7	nM	PubChem BioAssay data set
NPT6	Organism	Plasmodium falciparum	Plasmodium falciparum	Potency	n.a.	18526.0	nM	PubChem BioAssay data set
NPT566	Organism	Salmonella typhimurium	Salmonella enterica subsp. enterica serovar Typhimurium	IZ	=	12.0	mm	PMID[22440624]
NPT566	Organism	Salmonella typhimurium	Salmonella enterica subsp. enterica serovar Typhimurium	IZ	=	10.0	mm	PMID[22440624]
NPT566	Organism	Salmonella typhimurium	Salmonella enterica subsp. enterica serovar Typhimurium	IZ	=	9.0	mm	PMID[22440624]
NPT566	Organism	Salmonella typhimurium	Salmonella enterica subsp. enterica serovar Typhimurium	MIC	=	80000000.0	nM	PMID[22440624]
NPT21	Organism	Aspergillus niger	Aspergillus niger	MIC95	=	20.0	uM/ml	PMID[22683240]
NPT21	Organism	Aspergillus niger	Aspergillus niger	IZ	=	9.0	mm	PMID[22683240]
NPT2564	Organism	Blumeria graminis	Blumeria graminis	Activity	=	0.0	%	PMID[12617587]
NPT529	Organism	Rhizoctonia solani	Rhizoctonia solani	Activity	=	26.0	%	PMID[12617587]
NPT529	Organism	Rhizoctonia solani	Rhizoctonia solani	Activity	=	45.0	%	PMID[12617587]
NPT529	Organism	Rhizoctonia solani	Rhizoctonia solani	Activity	=	63.0	%	PMID[12617587]
NPT529	Organism	Rhizoctonia solani	Rhizoctonia solani	Activity	=	85.0	%	PMID[12617587]
NPT1198	Organism	Magnaporthe grisea	Magnaporthe grisea	Activity	=	0.0	%	PMID[12617587]
NPT22752	Protein complex	Transcription factor AP1	Homo sapiens	IC50	=	6.9	nM	PMID[24831826]
NPT22752	Protein complex	Transcription factor AP1	Homo sapiens	IC50	=	480000.0	nM	PMID[24831826]
NPT878	Organism	Streptococcus mutans	Streptococcus mutans	MIC	>	542900.0	nM	PMID[25746812]
NPT1830	Organism	Mycobacterium marinum	Mycobacterium marinum	IZ	=	1.1	mm	PMID[25618016]
NPT20555	Organism	SARS-CoV-2	Severe acute respiratory syndrome coronavirus 2	Hit score	=	0.2205	n.a.	DOI[10.1101/2020.04.21.054387]
NPT20555	Organism	SARS-CoV-2	Severe acute respiratory syndrome coronavirus 2	IC50	>	100000.0	nM	DOI[10.6019/CHEMBL4651402]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	EC50	=	10000.0	nM	PMID[17049256]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	17400.0	nM	PMID[18039573]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC70	=	24.6	uM	PMID[18039573]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	93.1	%	PMID[18295490]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	820.0	nM	PMID[18295490]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	420.0	nM	PMID[18295490]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	ED50	=	23.2	uM	PMID[11430002]
NPT20	Organism	Candida albicans	Candida albicans	IZ	=	15.0	mm	PMID[18201805]
NPT610	Others	Molecular identity unknown	n.a.	Activity	=	58.4	%	PMID[19179077]
NPT610	Others	Molecular identity unknown	n.a.	EC50	=	7480.0	nM	PMID[19179077]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	6400.0	nM	PMID[19243951]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	60.0	%	PMID[19329324]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	17000.0	nM	PMID[19329324]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	96.5	%	PMID[16038556]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	6100.0	nM	PMID[19725582]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	29500.0	nM	PMID[19725582]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	EC50	=	950.0	nM	PMID[19842664]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	EC50	=	10.0	nM	PMID[19842664]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Ratio	=	2.1	n.a.	PMID[19646881]
NPT343	Organism	Felid herpesvirus 1	Felid herpesvirus 1	EC50	>	271.0	nM	PMID[20034711]
NPT3795	Organism	Human immunodeficiency virus 2	Human immunodeficiency virus 2	IC50	=	37.0	nM	PMID[20034711]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	=	1230.0	nM	PMID[20034711]
NPT190	Organism	Human herpesvirus 1	Human herpesvirus 1	EC50	>	10.0	nM	PMID[20034711]
NPT1141	Organism	Human herpesvirus 2	Human herpesvirus 2	EC50	=	10.0	nM	PMID[20034711]
NPT334	Organism	Vaccinia virus	Vaccinia virus	EC50	=	10.0	nM	PMID[20034711]
NPT190	Organism	Human herpesvirus 1	Human herpesvirus 1	EC50	=	10.0	nM	PMID[20034711]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	75700.0	nM	PMID[20297825]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	22000.0	nM	PMID[20466556]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	18000.0	nM	PMID[22029378]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	27000.0	nM	PMID[20466556]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	deltaA	=	0.85	n.a.	PMID[20565070]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	96.8	%	PMID[21190861]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	20.0	ug.mL-1	PMID[19204190]
NPT20	Organism	Candida albicans	Candida albicans	IC50	=	421600.0	nM	PMID[19470507]
NPT20	Organism	Candida albicans	Candida albicans	IC50	=	492800.0	nM	PMID[19470507]
NPT20	Organism	Candida albicans	Candida albicans	IC50	=	410600.0	nM	PMID[19470507]
NPT20	Organism	Candida albicans	Candida albicans	IC50	=	498000.0	nM	PMID[19470507]
NPT20	Organism	Candida albicans	Candida albicans	IC50	=	454600.0	nM	PMID[19470507]
NPT20	Organism	Candida albicans	Candida albicans	Ratio IC50	=	1.16	n.a.	PMID[19470507]
NPT20	Organism	Candida albicans	Candida albicans	Ratio IC50	=	0.99	n.a.	PMID[19470507]
NPT20	Organism	Candida albicans	Candida albicans	Ratio IC50	=	1.18	n.a.	PMID[19470507]
NPT20	Organism	Candida albicans	Candida albicans	Ratio IC50	=	1.07	n.a.	PMID[19470507]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	TIME	=	0.0575	hr	PMID[21330013]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	TIME	=	0.0405	hr	PMID[21330013]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	GI50	=	16160.0	nM	PMID[21070043]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Ratio	=	2.5	n.a.	PMID[21840724]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	7000.0	nM	PMID[22029378]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	4700.0	nM	PMID[22029378]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	26000.0	nM	PMID[22029378]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	16000.0	nM	PMID[22029378]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	2750.0	nM	PMID[22832313]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	5760.0	nM	PMID[22889562]
NPT2894	Organism	Providencia rettgeri	Providencia rettgeri	MIC95	=	20.0	uM/ml	PMID[22683240]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	44.7	%	DOI[10.1007/s00044-011-9851-6]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	62.4	%	DOI[10.1007/s00044-011-9851-6]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	86.1	%	DOI[10.1007/s00044-011-9851-6]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	FC	=	3.0	n.a.	PMID[18284200]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	Activity	>	2.0	%	PMID[18284200]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	Activity	=	25.0	%	PMID[18284200]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	FC	=	2.0	n.a.	PMID[18284200]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	Activity	=	60.0	%	PMID[18284200]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	MIC	=	30.0	ug.mL-1	PMID[18284200]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	ED10	=	3.4	mM	DOI[10.1007/s00044-009-9199-3]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	ED25	=	4.8	mM	DOI[10.1007/s00044-009-9199-3]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	ED50	=	100.0	mM	DOI[10.1007/s00044-009-9199-3]
NPT829	Organism	Puccinia recondita	Puccinia recondita	Activity	=	63.0	%	PMID[12617587]
NPT829	Organism	Puccinia recondita	Puccinia recondita	Activity	=	76.0	%	PMID[12617587]
NPT829	Organism	Puccinia recondita	Puccinia recondita	Activity	=	100.0	%	PMID[12617587]
NPT825	Organism	Phytophthora infestans	Phytophthora infestans	Activity	=	57.0	%	PMID[12617587]
NPT825	Organism	Phytophthora infestans	Phytophthora infestans	Activity	=	85.0	%	PMID[12617587]
NPT825	Organism	Phytophthora infestans	Phytophthora infestans	Activity	=	100.0	%	PMID[12617587]
NPT635	Organism	Botryotinia fuckeliana	Botryotinia fuckeliana	Activity	=	0.0	%	PMID[12617587]
NPT635	Organism	Botryotinia fuckeliana	Botryotinia fuckeliana	Activity	=	15.0	%	PMID[12617587]
NPT635	Organism	Botryotinia fuckeliana	Botryotinia fuckeliana	Activity	=	40.0	%	PMID[12617587]
NPT635	Organism	Botryotinia fuckeliana	Botryotinia fuckeliana	Activity	=	70.0	%	PMID[12617587]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Inhibition	=	50.4	%	DOI[10.1007/s00044-012-0116-9]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Inhibition	=	87.64	%	DOI[10.1007/s00044-012-0116-9]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	18650.0	nM	PMID[23245570]
NPT610	Others	Molecular identity unknown	n.a.	Activity	=	34.0	%	PMID[23294827]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	2.5	equiv	PMID[23501115]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	2.8	equiv	PMID[23501115]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	>	100000.0	nM	PMID[23357628]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	4.6	%	PMID[23357628]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	5.8	%	PMID[23357628]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	13.7	%	PMID[23357628]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	22.2	%	PMID[23357628]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	45.0	%	PMID[23357628]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	11400.0	nM	PMID[23830698]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	28.3	ug.mL-1	PMID[23933533]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	17.03	ug.mL-1	PMID[23933533]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	8100.0	nM	PMID[24183537]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	3900.0	nM	PMID[26241103]
NPT610	Others	Molecular identity unknown	n.a.	EC50	=	20700.0	nM	PMID[24275249]
NPT610	Others	Molecular identity unknown	n.a.	Inhibition	=	59.4	%	PMID[24275249]
NPT610	Others	Molecular identity unknown	n.a.	Inhibition	=	27.1	%	PMID[24275249]
NPT610	Others	Molecular identity unknown	n.a.	Inhibition	=	62.8	%	PMID[24275249]
NPT610	Others	Molecular identity unknown	n.a.	Inhibition	=	82.5	%	PMID[24275249]
NPT610	Others	Molecular identity unknown	n.a.	Inhibition	=	89.3	%	PMID[24275249]
NPT610	Others	Molecular identity unknown	n.a.	Inhibition	=	99.4	%	PMID[24275249]
NPT610	Others	Molecular identity unknown	n.a.	Inhibition	=	98.2	%	PMID[24275249]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	530.0	nM	PMID[24467317]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	6700.0	nM	PMID[24689857]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	17.0	%	PMID[24689857]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	25.0	%	PMID[24689857]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	58.0	%	PMID[24689857]
NPT610	Others	Molecular identity unknown	n.a.	Activity	=	71.0	%	PMID[24689857]
NPT610	Others	Molecular identity unknown	n.a.	Activity	=	58.0	%	PMID[24689857]
NPT610	Others	Molecular identity unknown	n.a.	Activity	=	54.0	%	PMID[24689857]
NPT610	Others	Molecular identity unknown	n.a.	Activity	=	66.0	%	PMID[24689857]
NPT610	Others	Molecular identity unknown	n.a.	Activity	=	75.0	%	PMID[24689857]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	6010.0	nM	PMID[24960549]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	7990.0	nM	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	6.05	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	3.12	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	3.88	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	3.27	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	2.81	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	2.3	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	2.46	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	3.13	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	2.93	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	2.49	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	3.35	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	2.41	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	2.59	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	3.06	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	2.34	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	3.01	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	2.65	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	log2FC	=	2.78	n.a.	PMID[24960549]
NPT610	Others	Molecular identity unknown	n.a.	FC	=	2.0	n.a.	PMID[24960549]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	EC50	=	6000.0	nM	PMID[25051453]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	18520.0	nM	PMID[24909081]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Inhibition	=	2.08	%	PMID[24909081]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Inhibition	=	24.82	%	PMID[24909081]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	6460.0	nM	PMID[24657568]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	53.6	%	PMID[25577709]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	90.2	%	PMID[25577709]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	Activity	=	85.5	%	PMID[25577709]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	26.8	ug.mL-1	PMID[25881826]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	39420.0	nM	PMID[25728027]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	59020.0	nM	PMID[25728027]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	logMIC	=	1.0	n.a.	PMID[25666820]
NPT79	Organism	Bacillus subtilis	Bacillus subtilis	MIC	=	16.0	ug.mL-1	PMID[25938986]
NPT79	Organism	Bacillus subtilis	Bacillus subtilis	MIC	=	32.0	ug.mL-1	PMID[25938986]
NPT1228	Organism	Streptococcus pyogenes	Streptococcus pyogenes	MIC	>	128.0	ug.mL-1	PMID[25938986]
NPT626	Tissue	Liver microsome	Homo sapiens	Stability	<	20.0	%	PMID[26071636]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	IC50	=	20000.0	nM	PMID[26561365]
NPT22224	Cell line	Vero C1008	Chlorocebus sabaeus	CC50	n.a.	14800.0	nM	DOI[10.6019/CHEMBL4651402]
NPT22224	Cell line	Vero C1008	Chlorocebus sabaeus	pCC50	n.a.	4.83	n.a.	DOI[10.6019/CHEMBL4651402]
NPT164	Organism	Human herpesvirus 4	Human herpesvirus 4	Inhibition	=	0.0	%	PMID[17316910]
NPT164	Organism	Human herpesvirus 4	Human herpesvirus 4	Inhibition	=	22.8	%	PMID[17316910]
NPT164	Organism	Human herpesvirus 4	Human herpesvirus 4	Inhibition	=	81.7	%	PMID[17316910]
NPT164	Organism	Human herpesvirus 4	Human herpesvirus 4	Inhibition	=	100.0	%	PMID[17316910]
NPT164	Organism	Human herpesvirus 4	Human herpesvirus 4	IC50	=	10.2	nM	PMID[17503850]
NPT1515	Organism	SARS coronavirus	SARS coronavirus	EC50	>	10000.0	nM	PMID[17663539]
NPT1515	Organism	SARS coronavirus	SARS coronavirus	Inhibition	=	25.0	%	PMID[17663539]
NPT1515	Organism	SARS coronavirus	SARS coronavirus	Inhibition	=	50.0	%	PMID[17663539]
NPT164	Organism	Human herpesvirus 4	Human herpesvirus 4	IC50	=	345000.0	nM	PMID[17950604]
NPT19	Organism	Escherichia coli	Escherichia coli	IZ	=	10.0	mm	PMID[22440624]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	20000000.0	nM	PMID[18201805]
NPT1	Others	Radical scavenging activity	n.a.	IC50	=	109740.0	nM	PMID[19359068]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC90	=	73.7	ug.mL-1	PMID[19959361]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC90	>	500.0	ug.mL-1	PMID[19959361]
NPT19	Organism	Escherichia coli	Escherichia coli	Ratio	=	7.0	n.a.	PMID[19959361]
NPT4249	Organism	Influenza B virus	Influenza B virus	EC50	>	271.0	nM	PMID[20034711]
NPT24	Organism	Human immunodeficiency virus 1	Human immunodeficiency virus 1	IC50	=	37.0	nM	PMID[20034711]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1230.0	nM	PMID[20034711]
NPT1	Others	Radical scavenging activity	n.a.	Activity	=	35.0	%	PMID[22126405]
NPT1	Others	Radical scavenging activity	n.a.	EC50	=	22600.0	nM	PMID[21601463]
NPT1	Others	Radical scavenging activity	n.a.	Activity	=	10.0	%	PMID[21601463]
NPT1	Others	Radical scavenging activity	n.a.	EC50	=	13000.0	nM	PMID[22029378]
NPT23294	Cell line	C13	n.a.	Ratio IC50	=	3.4	n.a.	PMID[22029378]
NPT2907	Organism	Burkholderia pseudomallei	Burkholderia pseudomallei	IZ	=	8.0	mm	PMID[22440624]
NPT2907	Organism	Burkholderia pseudomallei	Burkholderia pseudomallei	IZ	=	9.0	mm	PMID[22440624]
NPT19	Organism	Escherichia coli	Escherichia coli	IZ	=	8.0	mm	PMID[22440624]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	IZ	=	11.0	mm	PMID[23685942]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	IZ	=	9.0	mm	PMID[22440624]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	40000000.0	nM	PMID[22440624]
NPT2907	Organism	Burkholderia pseudomallei	Burkholderia pseudomallei	MIC	=	80000000.0	nM	PMID[22440624]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	80000000.0	nM	PMID[22440624]
NPT16	Organism	Staphylococcus aureus	Staphylococcus aureus	MIC	=	80000000.0	nM	PMID[22440624]
NPT3540	Organism	Cochliobolus lunatus	Cochliobolus lunatus	IZ	=	11.0	mm	PMID[23685942]
NPT3540	Organism	Cochliobolus lunatus	Cochliobolus lunatus	IZ	=	9.0	mm	PMID[23685942]
NPT2567	Organism	Trichoderma viride	Hypocrea rufa	IZ	=	9.0	mm	PMID[23685942]
NPT2567	Organism	Trichoderma viride	Hypocrea rufa	MIC	=	80000000.0	nM	PMID[22440624]
NPT3540	Organism	Cochliobolus lunatus	Cochliobolus lunatus	MIC	=	80000000.0	nM	PMID[22440624]
NPT1	Others	Radical scavenging activity	n.a.	IC50	=	35100.0	nM	PMID[22995623]
NPT87	Organism	Aspergillus fumigatus	Aspergillus fumigatus	MIC95	=	20.0	uM/ml	PMID[22683240]
NPT87	Organism	Aspergillus fumigatus	Aspergillus fumigatus	IZ	=	12.0	mm	PMID[22683240]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC95	=	20.0	uM/ml	PMID[22683240]
NPT16	Organism	Staphylococcus aureus	Staphylococcus aureus	MIC95	=	20.0	uM/ml	PMID[22683240]
NPT16	Organism	Staphylococcus aureus	Staphylococcus aureus	MIC	=	80000.0	nM	PMID[23685942]
NPT2567	Organism	Trichoderma viride	Hypocrea rufa	MIC	>	80000.0	nM	PMID[23685942]
NPT3540	Organism	Cochliobolus lunatus	Cochliobolus lunatus	MIC	>	80000.0	nM	PMID[23685942]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	80000.0	nM	PMID[23685942]
NPT19	Organism	Escherichia coli	Escherichia coli	IZ	=	12.0	mm	PMID[23685942]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>	80000.0	nM	PMID[23685942]
NPT1	Others	Radical scavenging activity	n.a.	IC50	=	26500.0	nM	PMID[23357628]
NPT1	Others	Radical scavenging activity	n.a.	Activity	=	0.3	%	PMID[23357628]
NPT1	Others	Radical scavenging activity	n.a.	Activity	=	2.4	%	PMID[23357628]
NPT1	Others	Radical scavenging activity	n.a.	Activity	=	23.1	%	PMID[23357628]
NPT1	Others	Radical scavenging activity	n.a.	Activity	=	42.0	%	PMID[23357628]
NPT1	Others	Radical scavenging activity	n.a.	Activity	=	87.2	%	PMID[23357628]
NPT1	Others	Radical scavenging activity	n.a.	IC50	=	11.41	ug.mL-1	PMID[23933533]
NPT1	Others	Radical scavenging activity	n.a.	EC50	=	26600.0	nM	PMID[24657052]
NPT1	Others	Radical scavenging activity	n.a.	Activity	=	63.9	%	PMID[24920381]
NPT21757	Protein family	CREB-binding protein/Histone acetyltransferase p300	Homo sapiens	IC50	=	25000.0	nM	DOI[10.1039/C1MD00199J]
NPT621	Tissue	Plasma	Homo sapiens	Inhibition	=	19.2	%	PMID[25420236]
NPT621	Tissue	Plasma	Homo sapiens	Inhibition	=	18.6	%	PMID[25420236]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	128.0	ug.mL-1	PMID[25938986]
NPT16	Organism	Staphylococcus aureus	Staphylococcus aureus	MIC	>	128.0	ug.mL-1	PMID[25938986]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>	128.0	ug.mL-1	PMID[25938986]
NPT2	Others	Unspecified	n.a.	IC50	=	48000.0	nM	PMID[24960549]
NPT2	Others	Unspecified	n.a.	Inhibition	=	95.0	%	PMID[17145789]
NPT2	Others	Unspecified	n.a.	IC50	=	40000.0	nM	PMID[24960549]
NPT2	Others	Unspecified	n.a.	Inhibition	=	0.0	%	PMID[17685651]
NPT2	Others	Unspecified	n.a.	Inhibition	=	22.8	%	PMID[17685651]
NPT2	Others	Unspecified	n.a.	Inhibition	=	81.8	%	PMID[17685651]
NPT2	Others	Unspecified	n.a.	Inhibition	=	100.0	%	PMID[17685651]
NPT2	Others	Unspecified	n.a.	Inhibition	=	45.0	%	PMID[20452207]
NPT2	Others	Unspecified	n.a.	EC50	=	10000.0	nM	PMID[20452207]
NPT2	Others	Unspecified	n.a.	Inhibition	=	29.0	%	PMID[17284452]
NPT2	Others	Unspecified	n.a.	IC50	=	361110.0	nM	PMID[17284452]
NPT2	Others	Unspecified	n.a.	Activity	=	46.0	%	PMID[18434144]
NPT2	Others	Unspecified	n.a.	IC50	=	38300.0	nM	PMID[18678491]
NPT2	Others	Unspecified	n.a.	IC50	=	4200.0	nM	PMID[18678491]
NPT2	Others	Unspecified	n.a.	IC50	=	1020.0	nM	PMID[9599258]
NPT2	Others	Unspecified	n.a.	IC50	=	10000.0	nM	PMID[23164658]
NPT2	Others	Unspecified	n.a.	Activity	=	0.0	%	PMID[24411124]
NPT2	Others	Unspecified	n.a.	Activity	=	22.8	%	PMID[24411124]
NPT2	Others	Unspecified	n.a.	Activity	=	81.7	%	PMID[24411124]
NPT2	Others	Unspecified	n.a.	Activity	=	100.0	%	PMID[24411124]
NPT2	Others	Unspecified	n.a.	IC50	=	331000.0	nM	PMID[19131254]
NPT35	Others	n.a.	n.a.	Activity	>	64.0	%	PMID[19243951]
NPT35	Others	n.a.	n.a.	Activity	=	92.0	%	PMID[19243951]
NPT614	Tissue	Plasma	Rattus norvegicus	Stability	=	97.7	%	PMID[19243951]
NPT614	Tissue	Plasma	Rattus norvegicus	Stability	=	98.2	%	PMID[19243951]
NPT614	Tissue	Plasma	Rattus norvegicus	Stability	=	98.7	%	PMID[19243951]
NPT2	Others	Unspecified	n.a.	IC50	>	150000.0	nM	PMID[19114310]
NPT2	Others	Unspecified	n.a.	Kd	=	1150.0	nM	PMID[19329310]
NPT2	Others	Unspecified	n.a.	Kd	=	2450.0	nM	PMID[19329310]
NPT2	Others	Unspecified	n.a.	IC50	=	341.0	molar ratio	PMID[24411124]
NPT35	Others	n.a.	n.a.	IC50	>	500000.0	nM	PMID[19359068]
NPT2	Others	Unspecified	n.a.	Activity	=	8.9	%	PMID[19674905]
NPT2	Others	Unspecified	n.a.	Activity	=	40.3	%	PMID[19674905]
NPT2	Others	Unspecified	n.a.	Activity	=	74.5	%	PMID[19674905]
NPT2	Others	Unspecified	n.a.	Activity	=	95.8	%	PMID[19674905]
NPT2	Others	Unspecified	n.a.	IC50	=	345000.0	nM	PMID[19674905]
NPT338	Organism	Sindbis virus	Sindbis virus	EC50	>	10.0	nM	PMID[20034711]
NPT742	Organism	Influenza A virus	Influenza A virus	EC50	>	271.0	nM	PMID[20034711]
NPT2	Others	Unspecified	n.a.	Ratio CC50/IC50	<	1.0	n.a.	PMID[20034711]
NPT471	Organism	Trypanosoma brucei brucei	Trypanosoma brucei brucei	EC50	=	2500.0	nM	PMID[20004045]
NPT471	Organism	Trypanosoma brucei brucei	Trypanosoma brucei brucei	EC50	=	4700.0	nM	PMID[20004045]
NPT471	Organism	Trypanosoma brucei brucei	Trypanosoma brucei brucei	EC50	=	2900.0	nM	PMID[20004045]
NPT841	Organism	Leishmania major	Leishmania major	EC50	=	33000.0	nM	PMID[20004045]
NPT842	Organism	Leishmania mexicana	Leishmania mexicana	EC50	=	16000.0	nM	PMID[20004045]
NPT471	Organism	Trypanosoma brucei brucei	Trypanosoma brucei brucei	EC50	=	4800.0	nM	PMID[20004045]
NPT3843	Organism	Streptococcus viridans	Streptococcus viridans	MIC	=	2470.0	nM	PMID[20034711]
NPT195	Organism	Vesicular stomatitis virus	Vesicular stomatitis virus	EC50	>	10.0	nM	PMID[20034711]
NPT195	Organism	Vesicular stomatitis virus	Vesicular stomatitis virus	EC50	=	10.0	nM	PMID[20034711]
NPT336	Organism	Human parainfluenza virus 3	Human parainfluenza virus 3	EC50	>	10.0	nM	PMID[20034711]
NPT3878	Organism	Mammalian orthoreovirus 1	Mammalian orthoreovirus 1	EC50	>	10.0	nM	PMID[20034711]
NPT2	Others	Unspecified	n.a.	IC50	=	250000.0	nM	PMID[19813754]
NPT2	Others	Unspecified	n.a.	Inhibition	=	81.1	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	92.4	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	91.0	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	92.9	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	96.8	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	59.0	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	99.0	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	94.5	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	31.9	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	41.0	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	53.3	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	89.0	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	Inhibition	=	92.0	%	PMID[19653644]
NPT2	Others	Unspecified	n.a.	FC	=	2.0	n.a.	PMID[24960549]
NPT2	Others	Unspecified	n.a.	Inhibition	=	36.0	%	PMID[20346654]
NPT2	Others	Unspecified	n.a.	Activity	=	30.0	%	PMID[20227282]
NPT2	Others	Unspecified	n.a.	Inhibition	=	78.0	%	PMID[20227282]
NPT2	Others	Unspecified	n.a.	Inhibition	=	127.0	%	PMID[20227282]
NPT2	Others	Unspecified	n.a.	Activity	=	40.0	%	PMID[20227282]
NPT2	Others	Unspecified	n.a.	Activity	=	65.0	%	PMID[20227282]
NPT2	Others	Unspecified	n.a.	Activity	=	50.0	%	PMID[20227282]
NPT2	Others	Unspecified	n.a.	Activity	=	45.0	%	PMID[24961640]
NPT2	Others	Unspecified	n.a.	Activity	=	24.15	%	PMID[20170988]
NPT2	Others	Unspecified	n.a.	Activity	=	79.9	%	PMID[20170988]
NPT2	Others	Unspecified	n.a.	Activity	=	7.3	%	PMID[20170988]
NPT2	Others	Unspecified	n.a.	Activity	=	1.89	%	PMID[20170988]
NPT2	Others	Unspecified	n.a.	IC50	=	15000.0	nM	PMID[20728364]
NPT2	Others	Unspecified	n.a.	Inhibition	<	10.0	%	PMID[20951593]
NPT2	Others	Unspecified	n.a.	Potency	=	15848.9	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	Potency	=	14581.0	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	Potency	=	25118.9	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	Potency	=	31622.8	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	Inhibition	=	51.77	%	PMID[21211982]
NPT2	Others	Unspecified	n.a.	IC50	=	9600.0	nM	PMID[21112783]
NPT2	Others	Unspecified	n.a.	Inhibition	=	80.0	%	PMID[21435875]
NPT2	Others	Unspecified	n.a.	Activity	=	90.0	%	PMID[21435875]
NPT2	Others	Unspecified	n.a.	Inhibition	=	52.1	%	PMID[22978824]
NPT2	Others	Unspecified	n.a.	Ki	=	49.8	nM	PMID[21417461]
NPT2	Others	Unspecified	n.a.	Inhibition	=	34.4	%	PMID[21236667]
NPT2	Others	Unspecified	n.a.	Inhibition	=	33.26	%	PMID[21367493]
NPT2	Others	Unspecified	n.a.	Inhibition	=	50.0	%	PMID[21497959]
NPT2	Others	Unspecified	n.a.	Inhibition	=	38.0	%	PMID[21514701]
NPT2	Others	Unspecified	n.a.	IC50	=	9500.0	nM	PMID[21070043]
NPT2	Others	Unspecified	n.a.	IC50	=	12100.0	nM	PMID[21840724]
NPT2	Others	Unspecified	n.a.	Inhibition	=	71.3	%	PMID[21840724]
NPT2	Others	Unspecified	n.a.	Ki	=	5.01	10'5/M	PMID[21830815]
NPT2	Others	Unspecified	n.a.	IC50	=	20000.0	nM	PMID[26561365]
NPT2	Others	Unspecified	n.a.	Inhibition	=	41.8	%	PMID[21871694]
NPT2	Others	Unspecified	n.a.	Ki	=	3.57	nM	PMID[21885280]
NPT2	Others	Unspecified	n.a.	Potency	n.a.	12589.3	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	Inhibition	=	30.7	%	PMID[22019228]
NPT2	Others	Unspecified	n.a.	IC50	=	20300.0	nM	PMID[22137846]
NPT2	Others	Unspecified	n.a.	Inhibition	=	48.76	%	PMID[22444876]
NPT2	Others	Unspecified	n.a.	IC50	=	18700.0	nM	PMID[22472046]
NPT2	Others	Unspecified	n.a.	Activity	=	37.93	%	PMID[22546674]
NPT2	Others	Unspecified	n.a.	IC50	=	21360.0	nM	PMID[22889562]
NPT2	Others	Unspecified	n.a.	Potency	n.a.	15848.9	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	Potency	n.a.	11220.2	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	IC50	=	112000.0	nM	PMID[22989913]
NPT2	Others	Unspecified	n.a.	IC50	=	64000.0	nM	PMID[22989913]
NPT2	Others	Unspecified	n.a.	IC50	=	143000.0	nM	PMID[22989913]
NPT2	Others	Unspecified	n.a.	IC50	=	80000.0	nM	PMID[22989913]
NPT2	Others	Unspecified	n.a.	IC50	=	33000.0	nM	PMID[22989913]
NPT2	Others	Unspecified	n.a.	IC50	=	69000.0	nM	PMID[22989913]
NPT2	Others	Unspecified	n.a.	Inhibition	=	52.2	%	PMID[22944335]
NPT2	Others	Unspecified	n.a.	IC50	=	10400.0	nM	PMID[23041347]
NPT2	Others	Unspecified	n.a.	Ratio CC50/IC50	=	3.5	n.a.	PMID[22742496]
NPT194	Organism	Dengue virus 2	Dengue virus 2	IC50	=	4200.0	nM	PMID[22742496]
NPT35	Others	n.a.	n.a.	Activity	=	2.57	umol	PMID[22978824]
NPT314	Organism	Bacillus cereus	Bacillus cereus	MIC95	=	10.0	uM/ml	PMID[22683240]
NPT1242	Organism	Salmonella typhi	Salmonella enterica subsp. enterica serovar Typhi	MIC95	=	20.0	uM/ml	PMID[22683240]
NPT2	Others	Unspecified	n.a.	Inhibition	=	52.77	%	PMID[23127891]
NPT2	Others	Unspecified	n.a.	Potency	n.a.	29092.9	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	Inhibition	=	79.0	%	PMID[23524113]
NPT1242	Organism	Salmonella typhi	Salmonella enterica subsp. enterica serovar Typhi	MIC	>	80000.0	nM	PMID[23685942]
NPT1242	Organism	Salmonella typhi	Salmonella enterica subsp. enterica serovar Typhi	IZ	=	9.0	mm	PMID[23685942]
NPT1242	Organism	Salmonella typhi	Salmonella enterica subsp. enterica serovar Typhi	IZ	=	11.0	mm	PMID[23685942]
NPT314	Organism	Bacillus cereus	Bacillus cereus	MIC	>	80000.0	nM	PMID[23685942]
NPT314	Organism	Bacillus cereus	Bacillus cereus	IZ	=	9.0	mm	PMID[23685942]
NPT2	Others	Unspecified	n.a.	IC50	=	16400.0	nM	PMID[23742639]
NPT2	Others	Unspecified	n.a.	Ratio IC50	>	1.26	n.a.	DOI[10.1039/C3MD00376K]
NPT2	Others	Unspecified	n.a.	Potency	n.a.	1995.3	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	Potency	n.a.	25118.9	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	Potency	n.a.	22387.2	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	Potency	n.a.	35481.3	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	IC50	=	1200.0	nM	PMID[24920381]
NPT2	Others	Unspecified	n.a.	IC50	=	26000.0	nM	PMID[24960549]
NPT2	Others	Unspecified	n.a.	IC50	=	2500.0	nM	PMID[24960549]
NPT2	Others	Unspecified	n.a.	IC50	=	4800.0	nM	PMID[24960549]
NPT2	Others	Unspecified	n.a.	IC50	=	3800.0	nM	PMID[24960549]
NPT2	Others	Unspecified	n.a.	IC50	=	10120.0	nM	PMID[24938495]
NPT2	Others	Unspecified	n.a.	Inhibition	=	81.5	%	PMID[24938495]
NPT2	Others	Unspecified	n.a.	IC50	=	6000.0	nM	PMID[25277281]
NPT2	Others	Unspecified	n.a.	Inhibition	=	81.0	%	PMID[25577709]
NPT2	Others	Unspecified	n.a.	Inhibition	=	55.0	%	PMID[25577709]
NPT2	Others	Unspecified	n.a.	IC50	=	91500.0	nM	PMID[25746812]
NPT2	Others	Unspecified	n.a.	Activity	=	35.0	%	PMID[25791674]
NPT2	Others	Unspecified	n.a.	Kd	=	507000.0	nM	PMID[25681711]
NPT2	Others	Unspecified	n.a.	Activity	=	78.8	n.a.	PMID[25681711]
NPT2	Others	Unspecified	n.a.	Activity	=	36.4	n.a.	PMID[25681711]
NPT2	Others	Unspecified	n.a.	Potency	n.a.	17782.8	nM	PubChem BioAssay data set
NPT2	Others	Unspecified	n.a.	MIC	=	32.0	ug.mL-1	DOI[10.1039/C4MD00196F]
NPT2	Others	Unspecified	n.a.	FC	=	0.0	n.a.	DOI[10.1039/C4MD00196F]
NPT2	Others	Unspecified	n.a.	MIC	=	64.0	ug.mL-1	DOI[10.1039/C4MD00196F]
NPT35	Others	n.a.	n.a.	Inhibition	=	88.3	%	PMID[26071636]
NPT2	Others	Unspecified	n.a.	EC50	=	7480.0	nM	PMID[26386817]
NPT2	Others	Unspecified	n.a.	Activity	=	58.4	%	PMID[26386817]
NPT2	Others	Unspecified	n.a.	Activity	=	8.5	%	PMID[26386817]
NPT2	Others	Unspecified	n.a.	EC50	=	48500.0	nM	PMID[26386817]

In vivo activity

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference
NPT80	Cell line	Raji	Homo sapiens	Survival	=	60.0	%	PMID[17316910]
NPT80	Cell line	Raji	Homo sapiens	Survival	>	80.0	%	PMID[17316910]
NPT32	Organism	Mus musculus	Mus musculus	Inhibition	=	71.2	%	PMID[9871681]
NPT32	Organism	Mus musculus	Mus musculus	Inhibition	=	63.4	%	PMID[9871681]
NPT32	Organism	Mus musculus	Mus musculus	Inhibition	=	98.8	%	PMID[9871681]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	45.1	%	PMID[19131254]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	106.0	%	PMID[21190861]
NPT32	Organism	Mus musculus	Mus musculus	Inhibition	=	12.9	%	PMID[23685942]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	5.02	U/L	PMID[23145932]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	7.13	U/L	PMID[23145932]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	589.0	K/uL	PMID[23145932]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	485.0	K/uL	PMID[23145932]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	6.83	K/uL	PMID[23145932]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	4.69	K/uL	PMID[23145932]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	31.1	%	PMID[23145932]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	30.6	%	PMID[23145932]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	0.139	g	PMID[23145932]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	0.129	g	PMID[23145932]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	1.1	g	PMID[23145932]
NPT32	Organism	Mus musculus	Mus musculus	Activity	=	0.987	g	PMID[23145932]
NPT605	Organism	Homo sapiens	Homo sapiens	Bioavailability Increase	=	2000.0	%	PMID[17004725]
NPT29	Organism	Rattus norvegicus	Rattus norvegicus	Inhibition	=	-44.3	%	PMID[9871681]
NPT29	Organism	Rattus norvegicus	Rattus norvegicus	Inhibition	=	80.0	%	PMID[15878268]
NPT29	Organism	Rattus norvegicus	Rattus norvegicus	Bioavailability Increase	=	154.0	%	PMID[17004725]

Experimental ADME

Experiment Model	Experiment Tissue	ADME Type	ADME Relation	ADME Value	ADME Unit	Reference
Homo sapiens	Blood	Drug uptake	=	1.3	uM	PMID[19243951]
Homo sapiens	Liver	Drug uptake	=	1.3	uM	PMID[19243951]
Rattus norvegicus	Plasma	Drug metabolism	=	55.27	%	PMID[25728027]

Experimental Toxicity

Quantitative toxicity

Experiment Model	Experiment Organism	Toxicity Type	Toxicity Relation	Toxicity Value	Toxicity Unit	Reference

Common Abbreviations:
LC: Lethal Concentration; LD: Lethal Dose; LT:Lethal Time; NOAEL: No-observed-adverse-effect Level; BMDL: Benchmark Dose Lower Confidence Limit; BMD: Benchmark Dose; BMC:Benchmark Concentration; LOAEL: Lowest Observed Adverse Effect Level; RfD:Reference Dose; RfC:Reference Concentration; MRL: Minimal Risk Level; MEG: Maximum Exposure Guideline; PAC: Protective Action Criteria

Categorical toxicity labels

Hepatotoxicity	Carcinogenicity	Mutagenicity	Cardiotoxicity	Respiratory Toxicity	Eye Irritation	Endocrine Disruption

Note for Reference:
In addition to directly collecting NP quantitative data from primary literature (where reference will provided as NCBI PMID or DOI links), NPASS also integrated NP toxicity records from domain-specific databases. These databases include:
☉ ToxValDB: a curated database that compiles quantitative toxicity values for chemicals from diverse public sources to support toxicological research and risk assessment.
☉ TOXRIC: a comprehensive, free-to-access, online database providing toxicological/feature data. The toxicity labels are retrieved from this database. [PMID: 36400569]

Chemically structural similarity

Similar Active Natural Products in NPASS

Top-200 similar NPs were calculated against the active-NP-set (includes approximately 50,000 NPs with experimentally-derived bioactivity available in NPASS)

Similarity is measured using the Tanimoto coefficient (Tc) , which compares the binary fingerprints of two molecules. Tc is calculated as the intersection divided by the union of '1' bits in the fingerprints, ranging from 0 to 1, with 1 indicating highest similarity.

● The left chart: Distribution of similarity level between NPC109083 and all remaining natural products in the NPASS database.
● The right table: Most similar natural products (Tc>=0.5 or Top200).

range	Tanimoto Coefficient
0-0.1	21216
0.1-0.2	23299
0.2-0.3	4609
0.3-0.4	601
0.4-0.5	92
0.5-0.6	26
0.6-0.7	8
0.7-0.8	0
0.8-0.85	0
0.85-0.9	1
0.9-0.95	1
0.95-1	0

Similarity Score	Similarity Level	Natural Product ID
0.9149	High Similarity	NPC189844
0.8776	High Similarity	NPC269843
0.75	Intermediate Similarity	NPC224814
0.7115	Intermediate Similarity	NPC158949
0.6875	Remote Similarity	NPC14007
0.6852	Remote Similarity	NPC84076
0.6735	Remote Similarity	NPC280001
0.6596	Remote Similarity	NPC130193
0.6596	Remote Similarity	NPC160900
0.6471	Remote Similarity	NPC60962
0.6078	Remote Similarity	NPC71941
0.6034	Remote Similarity	NPC90128
0.5962	Remote Similarity	NPC106659
0.589	Remote Similarity	NPC478447
0.587	Remote Similarity	NPC36108
0.587	Remote Similarity	NPC233731
0.587	Remote Similarity	NPC610203
0.5833	Remote Similarity	NPC78918
0.5833	Remote Similarity	NPC39793
0.5833	Remote Similarity	NPC139617
0.5811	Remote Similarity	NPC478446
0.5733	Remote Similarity	NPC478444
0.5733	Remote Similarity	NPC478448
0.5733	Remote Similarity	NPC478445
0.569	Remote Similarity	NPC474784
0.5658	Remote Similarity	NPC478449
0.5658	Remote Similarity	NPC478453
0.5658	Remote Similarity	NPC478450
0.56	Remote Similarity	NPC107588
0.56	Remote Similarity	NPC137537
0.5584	Remote Similarity	NPC478452
0.5536	Remote Similarity	NPC110313
0.5517	Remote Similarity	NPC304622
0.5513	Remote Similarity	NPC478451
0.5217	Remote Similarity	NPC246358
0.5185	Remote Similarity	NPC202474
0.5091	Remote Similarity	NPC66905
0.5082	Remote Similarity	NPC253455

Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

● The left chart: Distribution of similarity level between NPC109083 and all drugs/candidates.
● The right table: Most similar clinical/approved drugs (Tc>=0.5 or Top200).

range	Tanimoto Coefficient
0-0.1	4254
0.1-0.2	4749
0.2-0.3	141
0.3-0.4	4
0.4-0.5	1
0.5-0.6	0
0.6-0.7	1
0.7-0.8	0
0.8-0.85	0
0.85-0.9	0
0.9-0.95	0
0.95-1	0

Similarity Score	Similarity Level	Drug ID	Developmental Stage
0.6596	Remote Similarity	NPD4379	Clinical (unspecified phase)

Bioactivity similarity

Similar Natural Products in NPASS

Similarity level is defined by Bioactivity similarity was calculated based on bioactivity descriptors of compounds. The bioactivity descriptors were calculated by a recently developed AI algorithm Chemical Checker (CC) [Nature Biotechnology, 38:1087–1096, 2020; Nature Communications, 12:3932, 2021], which evaluated bioactivity similarities at five levels:
☉ A: chemistry similarity;
☉ B: biological targets similarity;
☉ C: networks similarity;
☉ D: cell-based bioactivity similarity;
☉ E: similarity based on clinical data.
Those 5 categories of CC bioactivity descriptors were calculated and then subjected to manifold projection using UMAP algorithm, to project all NPs on a 2-Dimensional space. The current NP was highlighted with a small circle in the 2-D map. Below figures: left-to-right, A-to-E.

A: chemistry similarity

B: biological targets similarity

C: networks similarity

D: cell-based bioactivity similarity

E: similarity based on clinical data