NPASS Compound

Structure

CID100079 OpenBabel06191715442D 26 30 0 0 0 0 0 0 0 0999 V2000 0.8660 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1962 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7321 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4641 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1369 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7321 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7321 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4641 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0000 -0.0000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.3301 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5981 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5491 -2.8090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5491 -1.1910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 17 1 0 0 0 0 8 12 2 0 0 0 0 8 18 1 0 0 0 0 9 15 2 0 0 0 0 9 19 1 0 0 0 0 10 16 2 0 0 0 0 10 22 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 20 1 0 0 0 0 15 20 1 0 0 0 0 16 21 1 0 0 0 0 17 21 2 0 0 0 0 17 23 1 0 0 0 0 18 19 2 0 0 0 0 18 25 1 0 0 0 0 19 26 1 0 0 0 0 20 22 2 0 0 0 0 21 24 1 0 0 0 0 M CHG 1 22 1 M END $$$$

Physi-Chem Properties

Molecular Weight:	348.12
Volume:	352.738
LogP:	4.916
LogD:	3.753
LogS:	-7.891
# Rotatable Bonds:	2
TPSA:	40.8
# H-Bond Aceptor:	5
# H-Bond Donor:	0
# Rings:	5
# Heavy Atoms:	5

MedChem Properties

QED Drug-Likeness Score:	0.409
Synthetic Accessibility Score:	2.687
Fsp3:	0.19
Lipinski Rule-of-5:	Accepted
Pfizer Rule:	Rejected
GSK Rule:	Rejected
BMS Rule:	0
Golden Triangle Rule:	Accepted
Chelating Alert:	0
PAINS Alert:	0

ADMET Properties (ADMETlab2.0)

ADMET: Absorption

Caco-2 Permeability:	-4.99
MDCK Permeability:	7.663649739697576e-05
Pgp-inhibitor:	0.009
Pgp-substrate:	1.0
Human Intestinal Absorption (HIA):	0.005
20% Bioavailability (F20%):	0.01
30% Bioavailability (F30%):	0.959

ADMET: Distribution

Blood-Brain-Barrier Penetration (BBB):	0.875
Plasma Protein Binding (PPB):	72.13766479492188%
Volume Distribution (VD):	0.971
Pgp-substrate:	3.1540770530700684%

ADMET: Metabolism

CYP1A2-inhibitor:	0.933
CYP1A2-substrate:	0.938
CYP2C19-inhibitor:	0.628
CYP2C19-substrate:	0.884
CYP2C9-inhibitor:	0.035
CYP2C9-substrate:	0.874
CYP2D6-inhibitor:	0.933
CYP2D6-substrate:	0.941
CYP3A4-inhibitor:	0.453
CYP3A4-substrate:	0.247

ADMET: Excretion

Clearance (CL):	13.059
Half-life (T1/2):	0.165

ADMET: Toxicity

hERG Blockers:	0.067
Human Hepatotoxicity (H-HT):	0.119
Drug-inuced Liver Injury (DILI):	0.908
AMES Toxicity:	0.905
Rat Oral Acute Toxicity:	0.097
Maximum Recommended Daily Dose:	0.846
Skin Sensitization:	0.705
Carcinogencity:	0.957
Eye Corrosion:	0.003
Eye Irritation:	0.716
Respiratory Toxicity:	0.779

Download Data

Data Type	Select
General Info & Identifiers & Properties
Structure MOL file
Source Organisms
Biological Activities
Similar NPs/Drugs

Natural Product: NPC100079

Natural Product ID:	NPC100079
*Common Name:**	Chelerythrine
IUPAC Name:	1,2-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium
Synonyms:	Chelerythrine
Standard InCHIKey:	LLEJIEBFSOEYIV-UHFFFAOYSA-N
Standard InCHI:	InChI=1S/C21H18NO4/c1-22-10-16-13(6-7-17(23-2)21(16)24-3)14-5-4-12-8-18-19(26-11-25-18)9-15(12)20(14)22/h4-10H,11H2,1-3H3/q+1
SMILES:	COc1c(OC)ccc2c1c[n+](C)c1c2ccc2c1cc1OCOc1c2
Synthetic Gene Cluster:	n.a.
ChEMBL Identifier:	CHEMBL13045
PubChem CID:	2703
Chemical Classification:**	CHEMONTID:0000000 [Organic compounds] [CHEMONTID:0000279] Alkaloids and derivatives [CHEMONTID:0002665] Benzophenanthridine alkaloids [CHEMONTID:0002669] Quaternary benzophenanthridine alkaloids

*Note: the InCHIKey will be temporarily assigned as the "Common Name" if no IUPAC name or alternative short name is available.
**Note: the Chemical Classification was calculated by NPClassifier Version 1.5. Reference: PMID:34662515.

Species Source

Organism ID	Organism Name	Taxonomy Level	Family	SuperKingdom	Isolation Part	Collection Location	Collection Time	Reference
NPO26992	Sophora leachiana	Species	Fabaceae	Eukaryota	n.a.	root	n.a.	DOI[10.1016/0031-9422(90)85209-X]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	n.a.	root	n.a.	DOI[10.5012/bkcs.2003.24.11.1699]
NPO26409	Plakortis simplex	Species	Plakinidae	Eukaryota	n.a.	Caribbean	n.a.	PMID[10021943]
NPO24024	Fusarium semitectum	Species	Nectriaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[10978211]
NPO26409	Plakortis simplex	Species	Plakinidae	Eukaryota	n.a.	Taiwan	n.a.	PMID[11277748]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	n.a.	root	n.a.	PMID[11395279]
NPO16111	Broussonetia kazinoki	Species	Moraceae	Eukaryota	Leaves	n.a.	n.a.	PMID[11575957]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	whole plants	Shawnee National Forest, Harrisburg, IL, US	n.a.	PMID[11678652]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	whole plants	n.a.	n.a.	PMID[11678652]
NPO26193	Piper methysticum	Species	Piperaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[11830162]
NPO29080	Ulex airensis	Species	Fabaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[11858751]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	PMID[12419367]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	n.a.	root	n.a.	PMID[12510838]
NPO26193	Piper methysticum	Species	Piperaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[12809361]
NPO21424	Garcinia xanthochymus	Species	Clusiaceae	Eukaryota	n.a.	xylem	n.a.	PMID[14600386]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	n.a.	root	n.a.	PMID[15646793]
NPO21424	Garcinia xanthochymus	Species	Clusiaceae	Eukaryota	fruits	n.a.	n.a.	PMID[15787435]
NPO26409	Plakortis simplex	Species	Plakinidae	Eukaryota	n.a.	n.a.	n.a.	PMID[15921424]
NPO6328	Corydalis incisa	Species	Papaveraceae	Eukaryota	n.a.	aerial part	n.a.	PMID[17366734]
NPO25373	Stereocaulon alpinum	Species	Stereocaulaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[18288807]
NPO9650	Zanthoxylum nitidum	Species	Rutaceae	Eukaryota	stem bark	n.a.	n.a.	PMID[18303853]
NPO9650	Zanthoxylum nitidum	Species	Rutaceae	Eukaryota	Stems; Barks	n.a.	n.a.	PMID[18303853]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	leaves	Kaohsiung, Taiwan	2006-SEP	PMID[18986201]
NPO16111	Broussonetia kazinoki	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	PMID[19046886]
NPO26203	Dysidea villosa	Species	Dysideidae	Eukaryota	n.a.	Hainan, China	n.a.	PMID[19091557]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	Fruits	n.a.	n.a.	PMID[19296617]
NPO16111	Broussonetia kazinoki	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	PMID[20493686]
NPO25345	Corydalis ternata	Species	Papaveraceae	Eukaryota	tubers	n.a.	n.a.	PMID[20594848]
NPO3504	Argemone mexicana	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	PMID[21094631]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[21625478]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	n.a.	root	n.a.	PMID[21657081]
NPO24024	Fusarium semitectum	Species	Nectriaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[22439674]
NPO26409	Plakortis simplex	Species	Plakinidae	Eukaryota	n.a.	n.a.	n.a.	PMID[23806071]
NPO5315	Zanthoxylum bungeanum	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[24175626]
NPO7213	Toddalia asiatica	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[24597921]
NPO26428	Ligularia sagitta	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	PMID[24913558]
NPO26409	Plakortis simplex	Species	Plakinidae	Eukaryota	n.a.	China	n.a.	PMID[25115700]
NPO26193	Piper methysticum	Species	Piperaceae	Eukaryota	root	n.a.	n.a.	PMID[25597012]
NPO26298	Zanthoxylum simulans	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[26666037]
NPO18823	Colysis pothifolia	Species	Polypodiaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[26731047]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[27444348]
NPO25406	Celastrus monospermus	Species	Celastraceae	Eukaryota	n.a.	n.a.	n.a.	PMID[28006915]
NPO25373	Stereocaulon alpinum	Species	Stereocaulaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[29878768]
NPO22441	Senna spectabilis	Species	Fabaceae	Eukaryota	flowers	n.a.	n.a.	PMID[30413343]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	Roots	n.a.	n.a.	PMID[31464439]
NPO26298	Zanthoxylum simulans	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[7798955]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	n.a.	formosan	n.a.	PMID[8864236]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	PMID[9358644]
NPO25657	Mezzettia leptopoda	Species	Annonaceae	Eukaryota	n.a.	n.a.	n.a.	PMID[9868159]
NPO16111	Broussonetia kazinoki	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	PMID[9917310]
NPO20871	Pueraria tuberosa	Species	Fabaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO21424	Garcinia xanthochymus	Species	Clusiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO23223	Symphytum officinale	Species	Boraginaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO26298	Zanthoxylum simulans	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO28612	Hypecoum leptocarpum	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO26428	Ligularia sagitta	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO9650	Zanthoxylum nitidum	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO7213	Toddalia asiatica	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO26992	Sophora leachiana	Species	Fabaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO19264	Macleaya cordata	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO25122	Conium maculatum	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO21004	Nicotiana plumbaginifolia	Species	Solanaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO24478	Morinda coreia	Species	Rubiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO11457	Chelidonium majus	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO6328	Corydalis incisa	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO18366	Papaver commutatum	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO1106	Artabotrys maingayi	Species	Annonaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO22043	Hylomecon japonica	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO24480	Diospyros ebenum	Species	Ebenaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO26193	Piper methysticum	Species	Piperaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO19672	Hosta sieboldiana	Species	Asparagaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO3504	Argemone mexicana	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO16414	Thuja plicata	Species	Cupressaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO5315	Zanthoxylum bungeanum	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[HerDing]
NPO18594	Rutaceae spp.	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO25166	Corydalis ophiocarpa	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO26193	Piper methysticum	Species	Piperaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO8582	Dicentra spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO24087	Psacalium peltatum	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO15732	Bocconia spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO18366	Papaver commutatum	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO1106	Artabotrys maingayi	Species	Annonaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO15611	Chelidonium spp.	Species	Cerambycidae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO19636	Corydalis spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO6676	Fumariaceae spp.	Species	n.a.	n.a.	n.a.	n.a.	n.a.	Database[TCMID]
NPO19051	Toddalia spp.	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO3504	Argemone mexicana	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO23842	Stylophorum spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO21492	Argemone spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO28264	Dicranostigma spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO17397	Sanguinaria spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO24707	Pteridophyllum spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO19264	Macleaya cordata	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO5315	Zanthoxylum bungeanum	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO7549	Zanthoxylum spp.	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO16414	Thuja plicata	Species	Cupressaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO21004	Nicotiana plumbaginifolia	Species	Solanaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO26992	Sophora leachiana	Species	Fabaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO17573	Platystemon spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO29305	Sapindaceae spp.	Species	Sapindaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO25122	Conium maculatum	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO3402	Macleaya spp.	Species	Culicidae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO6328	Corydalis incisa	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO4732	Papaveraceae spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO26298	Zanthoxylum simulans	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO22043	Hylomecon japonica	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO19672	Hosta sieboldiana	Species	Asparagaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO20871	Pueraria tuberosa	Species	Fabaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO5659	Glaucium spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO11457	Chelidonium majus	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO18430	Eschscholzia spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO26230	Lappula echinata	Species	Boraginaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO24297	Hunnemannia spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO7213	Toddalia asiatica	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO17796	Lamprocapnos spectabilis	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO1474	Hylomecon spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO16111	Broussonetia kazinoki	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO939	Fagara spp.	Species	n.a.	n.a.	n.a.	n.a.	n.a.	Database[TCMID]
NPO28612	Hypecoum leptocarpum	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO26428	Ligularia sagitta	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO24478	Morinda coreia	Species	Rubiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO9650	Zanthoxylum nitidum	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO6057	Stylomecon spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO23223	Symphytum officinale	Species	Boraginaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO25373	Stereocaulon alpinum	Species	Stereocaulaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO21424	Garcinia xanthochymus	Species	Clusiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO13313	Talipariti tiliaceum	Species	Malvaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO18032	Papaver spp.	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO24480	Diospyros ebenum	Species	Ebenaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCMID]
NPO6328	Corydalis incisa	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO3504	Argemone mexicana	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO26193	Piper methysticum	Species	Piperaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO5315	Zanthoxylum bungeanum	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO25166	Corydalis ophiocarpa	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO20871	Pueraria tuberosa	Species	Fabaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO22043	Hylomecon japonica	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO18366	Papaver commutatum	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO24480	Diospyros ebenum	Species	Ebenaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO9650	Zanthoxylum nitidum	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO26298	Zanthoxylum simulans	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO19672	Hosta sieboldiana	Species	Asparagaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO11457	Chelidonium majus	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO25122	Conium maculatum	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO7213	Toddalia asiatica	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO23223	Symphytum officinale	Species	Boraginaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TCM_Taiwan]
NPO11457	Chelidonium majus	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO5315	Zanthoxylum bungeanum	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO16111	Broussonetia kazinoki	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO9650	Zanthoxylum nitidum	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO25345	Corydalis ternata	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	Database[TM-MC]
NPO25833	Asclepias subulata	Species	Apocynaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO26992	Sophora leachiana	Species	Fabaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO24868	Streptomyces aizunensis	Species	Streptomycetaceae	Bacteria	n.a.	n.a.	n.a.	Database[UNPD]
NPO7213	Toddalia asiatica	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO18823	Colysis pothifolia	Species	Polypodiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO26230	Lappula echinata	Species	Boraginaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO28636	Vernonia lilacina	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO26789	Tephrosia bidwilli	Species	Geometridae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO19672	Hosta sieboldiana	Species	Asparagaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO8315	Wunderlichia crulsiana	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO21230	Heterodermia obscurata	Species	Physciaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25881	Stachys plumosa	Species	Lamiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO21424	Garcinia xanthochymus	Species	Clusiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO20271	Canarina canariensis	Species	Campanulaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO18366	Papaver commutatum	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO5515	Cephalocroton cordofanus	Species	Euphorbiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO22441	Senna spectabilis	Species	Fabaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO24024	Fusarium semitectum	Species	Nectriaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO21143	Cryptocarya canelilla	Species	Lauraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25358	Senecio gilliesi	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO8144	Labidiaster annulatus	Species	Labidiasteridae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO18580	Diabelia spathulata	Species	Caprifoliaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO26193	Piper methysticum	Species	Piperaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25201	Aglaia pyramidata	Species	Meliaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO21004	Nicotiana plumbaginifolia	Species	Solanaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO1267	Acronychia laurifolia	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO9324	0techis scutatus	Species	Elapidae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO336	Chaetomorpha moniligera	Species	Cladophoraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO24478	Morinda coreia	Species	Rubiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO3963	Hortonia floribunda	Species	Monimiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25624	Teclea sudanica	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO9944	Salisaeta longa	Species	Rhodothermaceae	Bacteria	n.a.	n.a.	n.a.	Database[UNPD]
NPO9650	Zanthoxylum nitidum	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25166	Corydalis ophiocarpa	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO19340	Orobanche caerulescens	Species	Orobanchaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO29080	Ulex airensis	Species	Fabaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO22264	Inula salsoloides	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO5564	Laurencia japonensis	Species	Rhodomelaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO20871	Pueraria tuberosa	Species	Fabaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO6983	Pavonia zeylanica	Species	Malvaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO24480	Diospyros ebenum	Species	Ebenaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO6338	Chilo auricilius	Species	Crambidae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO9245	Ventilago madraspatana	Species	Rhamnaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO23296	Teucrium carolipaui	Species	Lamiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO18613	Commiphora erlangeriana	Species	Burseraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO405	Hyptis spicata	Species	Lamiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25484	Bumelia obtusifolia	n.a.	n.a.	n.a.	n.a.	n.a.	n.a.	Database[UNPD]
NPO26690	Lactarius subpiperatus	Species	Lactariidae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25406	Celastrus monospermus	Species	Celastraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO23223	Symphytum officinale	Species	Boraginaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25373	Stereocaulon alpinum	Species	Stereocaulaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO24547	Xanthoria parietina	Species	Teloschistaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO26298	Zanthoxylum simulans	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO13313	Talipariti tiliaceum	Species	Malvaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO26160	Thielavia terricola	Species	Chaetomiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO24087	Psacalium peltatum	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO13216	Streptomyces pulveraceus	Species	Streptomycetaceae	Bacteria	n.a.	n.a.	n.a.	Database[UNPD]
NPO26409	Plakortis simplex	Species	Plakinidae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO19264	Macleaya cordata	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO16414	Thuja plicata	Species	Cupressaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO26203	Dysidea villosa	Species	Dysideidae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO26428	Ligularia sagitta	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO24918	Jacobaea cannabifolia	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO3504	Argemone mexicana	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25316	Lasius niger	Species	Formicidae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO6328	Corydalis incisa	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25657	Mezzettia leptopoda	Species	Annonaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO4790	Bocconia cordata	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO15221	Crambe fruticosa	Species	Brassicaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO21677	Liatris aspera	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO26849	Parmelia zollingeri	Species	Parmeliaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25619	Vitex divaricata	Species	Lamiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO10509	Phebalium ralstoni	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO5348	Colletotrichum acutatum	Species	Glomerellaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25802	Agave deserti	Species	Asparagaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25505	Astilbe japonica	Species	Saxifragaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO17796	Lamprocapnos spectabilis	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO20801	Antrodia sinuosa	Species	Fomitopsidaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO22890	Eutrochium purpureum	Species	Asteraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO5315	Zanthoxylum bungeanum	Species	Rutaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO3005	Passiflora morifolia	Species	Passifloraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO5495	Broussonetia papyrifera	Species	Moraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO22043	Hylomecon japonica	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO7177	Inocybe rimosa	Species	Inocybaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO1844	Osmanthus armatus	Species	Oleaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25714	Solanum spirale	Species	Solanaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO24758	Angelica dahurica	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO1106	Artabotrys maingayi	Species	Annonaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO18421	Tachardia lacca	n.a.	n.a.	n.a.	n.a.	n.a.	n.a.	Database[UNPD]
NPO25345	Corydalis ternata	Species	Papaveraceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25122	Conium maculatum	Species	Apiaceae	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO29053	Dictyostelium longosporum	Species	n.a.	Eukaryota	n.a.	n.a.	n.a.	Database[UNPD]
NPO25259	Schrebera swietenoides	Species	Oleaceae	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	NP ID	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
AC50	5
EC50	2
IC50	18
Ki	1
MIC	4
Others	504
Potency	113

Activity Type	# Activity
Cell Line	9
Individual Protein	536
NON-MOLECULAR	12
NUCLEIC-ACID	2
Organism	13
Others	48
Protein Complex	24
Protein-Protein Interaction	2
SINGLE PROTEIN	1

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference
NPT46	Individual Protein	Thyroid hormone receptor beta-1	Homo sapiens	Potency	=	70794.6	nM	PMID[448598]
NPT163	Individual Protein	Nuclear factor NF-kappa-B p105 subunit	Homo sapiens	Potency	=	11220.2	nM	PMID[448599]
NPT149	Individual Protein	Endoplasmic reticulum-associated amyloid beta-peptide-binding protein	Homo sapiens	Potency	=	25118.9	nM	PMID[448599]
NPT537	Individual Protein	Ras-related protein Rab-9A	Homo sapiens	Potency	=	46109.1	nM	PMID[448600]
NPT210	Individual Protein	Thyroid stimulating hormone receptor	Homo sapiens	Potency	=	25118.9	nM	PMID[448599]
NPT50	Individual Protein	Tyrosyl-DNA phosphodiesterase 1	Homo sapiens	Potency	=	63095.7	nM	PMID[448598]
NPT484	Individual Protein	Luciferin 4-monooxygenase	Photinus pyralis	Potency	=	31622.8	nM	PMID[448599]
NPT51	Individual Protein	Microtubule-associated protein tau	Homo sapiens	Potency	=	17782.8	nM	PMID[448598]
NPT51	Individual Protein	Microtubule-associated protein tau	Homo sapiens	Potency	=	14125.4	nM	PMID[448601]
NPT213	Individual Protein	Cytochrome P450 2C19	Homo sapiens	Potency	=	10000.0	nM	PMID[448599]
NPT51	Individual Protein	Microtubule-associated protein tau	Homo sapiens	Potency	=	15848.9	nM	PMID[448601]
NPT51	Individual Protein	Microtubule-associated protein tau	Homo sapiens	Potency	=	15848.9	nM	PMID[448598]
NPT531	Individual Protein	Nuclear receptor ROR-gamma	Mus musculus	Potency	=	8912.5	nM	PMID[448598]
NPT211	Individual Protein	Hypoxia-inducible factor 1 alpha	Homo sapiens	Potency	=	31622.8	nM	PMID[448599]
NPT53	Individual Protein	4'-phosphopantetheinyl transferase ffp	Bacillus subtilis	Potency	=	56234.1	nM	PMID[448602]
NPT53	Individual Protein	4'-phosphopantetheinyl transferase ffp	Bacillus subtilis	Potency	=	50118.7	nM	PMID[448601]
NPT53	Individual Protein	4'-phosphopantetheinyl transferase ffp	Bacillus subtilis	Potency	=	25118.9	nM	PMID[448598]
NPT583	Individual Protein	Inositol monophosphatase 1	Rattus norvegicus	Potency	=	5011.9	nM	PMID[448601]
NPT51	Individual Protein	Microtubule-associated protein tau	Homo sapiens	Potency	=	501.2	nM	PMID[448601]
NPT282	Individual Protein	MAP kinase ERK2	Homo sapiens	Potency	=	31622.8	nM	PMID[448599]
NPT1119	Individual Protein	Arachidonate 12-lipoxygenase	Homo sapiens	Potency	=	12589.3	nM	PMID[448598]
NPT55	Individual Protein	Putative fructose-1,6-bisphosphate aldolase	Giardia intestinalis	Potency	=	17740.7	nM	PMID[448598]
NPT55	Individual Protein	Putative fructose-1,6-bisphosphate aldolase	Giardia intestinalis	Potency	=	5000.0	nM	PMID[448602]
NPT150	Individual Protein	Anthrax lethal factor	Bacillus anthracis	Potency	=	25118.9	nM	PMID[448599]
NPT538	Individual Protein	Niemann-Pick C1 protein	Homo sapiens	Potency	=	58047.9	nM	PMID[448600]
NPT45	Individual Protein	Ubiquitin carboxyl-terminal hydrolase 2	Homo sapiens	Potency	=	25118.9	nM	PMID[448599]
NPT531	Individual Protein	Nuclear receptor ROR-gamma	Mus musculus	Potency	=	7079.5	nM	PMID[448602]
NPT531	Individual Protein	Nuclear receptor ROR-gamma	Mus musculus	Potency	=	3981.1	nM	PMID[448598]
NPT151	Individual Protein	15-hydroxyprostaglandin dehydrogenase [NAD+]	Homo sapiens	Potency	=	19952.6	nM	PMID[448598]
NPT149	Individual Protein	Endoplasmic reticulum-associated amyloid beta-peptide-binding protein	Homo sapiens	Potency	=	19952.6	nM	PMID[448599]
NPT539	Individual Protein	Cellular tumor antigen p53	Homo sapiens	Potency	=	5011.9	nM	PMID[448599]
NPT539	Individual Protein	Cellular tumor antigen p53	Homo sapiens	Potency	=	12589.3	nM	PMID[448599]
NPT110	Individual Protein	Cytochrome P450 2D6	Homo sapiens	Potency	=	25118.9	nM	PMID[448599]
NPT109	Individual Protein	Cytochrome P450 3A4	Homo sapiens	Potency	=	31622.8	nM	PMID[448599]
NPT212	Individual Protein	Cytochrome P450 2C9	Homo sapiens	Potency	=	39810.7	nM	PMID[448599]
NPT64	Individual Protein	ATPase family AAA domain-containing protein 5	Homo sapiens	Potency	n.a.	16353.5	nM	PMID[448600]
NPT152	Individual Protein	Nuclear factor erythroid 2-related factor 2	Homo sapiens	Potency	n.a.	16360.1	nM	PMID[448600]
NPT1482	Individual Protein	2,3-bisphosphoglycerate-independent phosphoglycerate mutase	Leishmania major	Potency	n.a.	15101.4	nM	PMID[448600]
NPT443	Individual Protein	Histone acetyltransferase GCN5	Homo sapiens	Potency	n.a.	31622.8	nM	PMID[448600]
NPT1623	Individual Protein	DNA polymerase III	Bacillus subtilis (strain 168)	Potency	n.a.	26679.5	nM	PMID[448600]
NPT5	Individual Protein	Histone-lysine N-methyltransferase, H3 lysine-9 specific 3	Homo sapiens	Potency	n.a.	16833.6	nM	PMID[448600]
NPT62	Individual Protein	6-phospho-1-fructokinase	Trypanosoma brucei	Potency	n.a.	19011.5	nM	PMID[448600]
NPT135	Individual Protein	Chromobox protein homolog 1	Homo sapiens	Potency	n.a.	50118.7	nM	PMID[448600]
NPT1139	Individual Protein	Arachidonate 15-lipoxygenase, type II	Homo sapiens	Potency	n.a.	15848.9	nM	PMID[448598]
NPT1139	Individual Protein	Arachidonate 15-lipoxygenase, type II	Homo sapiens	Potency	n.a.	12589.3	nM	PMID[448599]
NPT110	Individual Protein	Cytochrome P450 2D6	Homo sapiens	AC50	=	25118.86	nM	PMID[448599]
NPT213	Individual Protein	Cytochrome P450 2C19	Homo sapiens	AC50	=	10000.0	nM	PMID[448599]
NPT109	Individual Protein	Cytochrome P450 3A4	Homo sapiens	AC50	=	31622.78	nM	PMID[448599]
NPT208	Individual Protein	Cytochrome P450 1A2	Homo sapiens	AC50	=	10000.0	nM	PMID[448599]
NPT212	Individual Protein	Cytochrome P450 2C9	Homo sapiens	AC50	=	39810.72	nM	PMID[448599]
NPT198	Individual Protein	Vitamin D receptor	Homo sapiens	Potency	n.a.	28183.8	nM	PMID[448600]
NPT478	Individual Protein	Ataxin-2	Homo sapiens	Potency	n.a.	5623.4	nM	PMID[448600]
NPT71	Cell Line	HEK293	Homo sapiens	Potency	n.a.	4107.8	nM	PMID[448600]
NPT519	Cell Line	SH-SY5Y	Homo sapiens	Potency	n.a.	5623.4	nM	PMID[448600]
NPT622	Individual Protein	Solute carrier organic anion transporter family member 2B1	Homo sapiens	Inhibition	=	13.1	%	PMID[448606]
NPT3317	Individual Protein	Serine/threonine-protein kinase MARK1	Homo sapiens	Residual Activity	=	91.0	%	PMID[448608]
NPT3419	Individual Protein	Serine/threonine-protein kinase SRPK3	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT3419	Individual Protein	Serine/threonine-protein kinase SRPK3	Homo sapiens	Residual Activity	=	66.0	%	PMID[448608]
NPT3284	Individual Protein	Serine/threonine-protein kinase NEK7	Homo sapiens	Residual Activity	=	100.0	%	PMID[448608]
NPT3284	Individual Protein	Serine/threonine-protein kinase NEK7	Homo sapiens	Residual Activity	=	137.0	%	PMID[448608]
NPT3214	Individual Protein	Tyrosine-protein kinase ABL2	Homo sapiens	Residual Activity	=	82.0	%	PMID[448608]
NPT1432	Individual Protein	Serine/threonine-protein kinase Aurora-A	Homo sapiens	Residual Activity	=	83.0	%	PMID[448608]
NPT3266	Individual Protein	Casein kinase I delta	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT1721	Individual Protein	Death-associated protein kinase 1	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT3219	Individual Protein	Ephrin type-A receptor 5	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT3227	Individual Protein	Fibroblast growth factor receptor 3	Homo sapiens	Residual Activity	=	57.0	%	PMID[448608]
NPT3372	Individual Protein	Fibroblast growth factor receptor 4	Homo sapiens	Residual Activity	=	115.0	%	PMID[448608]
NPT14	Individual Protein	Tyrosine-protein kinase FYN	Homo sapiens	Residual Activity	=	63.0	%	PMID[448608]
NPT3205	Individual Protein	Tyrosine-protein kinase HCK	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3207	Individual Protein	c-Jun N-terminal kinase 3	Homo sapiens	Residual Activity	=	63.0	%	PMID[448608]
NPT491	Individual Protein	Dual specificity mitogen-activated protein kinase kinase 1	Homo sapiens	Residual Activity	=	125.0	%	PMID[448608]
NPT491	Individual Protein	Dual specificity mitogen-activated protein kinase kinase 1	Homo sapiens	Residual Activity	=	119.0	%	PMID[448608]
NPT1711	Individual Protein	Serine/threonine-protein kinase MST1	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3285	Individual Protein	Serine/threonine protein kinase NLK	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT1432	Individual Protein	Serine/threonine-protein kinase Aurora-A	Homo sapiens	Residual Activity	=	75.0	%	PMID[448608]
NPT3266	Individual Protein	Casein kinase I delta	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT1721	Individual Protein	Death-associated protein kinase 1	Homo sapiens	Residual Activity	=	71.0	%	PMID[448608]
NPT3236	Individual Protein	Death-associated protein kinase 2	Homo sapiens	Residual Activity	=	99.0	%	PMID[448608]
NPT3219	Individual Protein	Ephrin type-A receptor 5	Homo sapiens	Residual Activity	=	99.0	%	PMID[448608]
NPT3211	Individual Protein	Ephrin type-A receptor 7	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT3372	Individual Protein	Fibroblast growth factor receptor 4	Homo sapiens	Residual Activity	=	100.0	%	PMID[448608]
NPT3406	Individual Protein	Mitogen-activated protein kinase kinase kinase kinase 2	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT3406	Individual Protein	Mitogen-activated protein kinase kinase kinase kinase 2	Homo sapiens	Residual Activity	=	72.0	%	PMID[448608]
NPT1438	Individual Protein	Insulin-like growth factor I receptor	Homo sapiens	Residual Activity	=	138.0	%	PMID[448608]
NPT1438	Individual Protein	Insulin-like growth factor I receptor	Homo sapiens	Residual Activity	=	131.0	%	PMID[448608]
NPT1478	Individual Protein	Vascular endothelial growth factor receptor 2	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT1478	Individual Protein	Vascular endothelial growth factor receptor 2	Homo sapiens	Residual Activity	=	90.0	%	PMID[448608]
NPT3282	Individual Protein	Maternal embryonic leucine zipper kinase	Homo sapiens	Residual Activity	=	84.0	%	PMID[448608]
NPT1711	Individual Protein	Serine/threonine-protein kinase MST1	Homo sapiens	Residual Activity	=	98.0	%	PMID[448608]
NPT3331	Individual Protein	Serine/threonine-protein kinase MST2	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT3285	Individual Protein	Serine/threonine protein kinase NLK	Homo sapiens	Residual Activity	=	76.0	%	PMID[448608]
NPT1442	Individual Protein	Serine/threonine-protein kinase PAK 2	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT1433	Individual Protein	Serine/threonine-protein kinase Aurora-B	Homo sapiens	Residual Activity	=	130.0	%	PMID[448608]
NPT1433	Individual Protein	Serine/threonine-protein kinase Aurora-B	Homo sapiens	Residual Activity	=	60.0	%	PMID[448608]
NPT3236	Individual Protein	Death-associated protein kinase 2	Homo sapiens	Residual Activity	=	91.0	%	PMID[448608]
NPT3211	Individual Protein	Ephrin type-A receptor 7	Homo sapiens	Residual Activity	=	79.0	%	PMID[448608]
NPT3244	Individual Protein	Tyrosine-protein kinase FER	Homo sapiens	Residual Activity	=	115.0	%	PMID[448608]
NPT3244	Individual Protein	Tyrosine-protein kinase FER	Homo sapiens	Residual Activity	=	80.0	%	PMID[448608]
NPT3457	Individual Protein	G protein-coupled receptor kinase 5	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT1438	Individual Protein	Insulin-like growth factor I receptor	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT2574	Individual Protein	Insulin receptor	Homo sapiens	Residual Activity	=	117.0	%	PMID[448608]
NPT2574	Individual Protein	Insulin receptor	Homo sapiens	Residual Activity	=	130.0	%	PMID[448608]
NPT3242	Individual Protein	LIM domain kinase 1	Homo sapiens	Residual Activity	=	108.0	%	PMID[448608]
NPT3282	Individual Protein	Maternal embryonic leucine zipper kinase	Homo sapiens	Residual Activity	=	31.0	%	PMID[448608]
NPT3381	Individual Protein	Misshapen-like kinase 1	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT3331	Individual Protein	Serine/threonine-protein kinase MST2	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT1442	Individual Protein	Serine/threonine-protein kinase PAK 2	Homo sapiens	Residual Activity	=	81.0	%	PMID[448608]
NPT3206	Individual Protein	Serine/threonine-protein kinase Aurora-C	Homo sapiens	Residual Activity	=	104.0	%	PMID[448608]
NPT3273	Individual Protein	Casein kinase II alpha (prime)	Homo sapiens	Residual Activity	=	126.0	%	PMID[448608]
NPT3273	Individual Protein	Casein kinase II alpha (prime)	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT3336	Individual Protein	Serine/threonine-protein kinase DCLK2	Homo sapiens	Residual Activity	=	98.0	%	PMID[448608]
NPT3336	Individual Protein	Serine/threonine-protein kinase DCLK2	Homo sapiens	Residual Activity	=	90.0	%	PMID[448608]
NPT3216	Individual Protein	Ephrin type-A receptor 8	Homo sapiens	Residual Activity	=	108.0	%	PMID[448608]
NPT3216	Individual Protein	Ephrin type-A receptor 8	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT3457	Individual Protein	G protein-coupled receptor kinase 5	Homo sapiens	Residual Activity	=	82.0	%	PMID[448608]
NPT4088	Individual Protein	G protein-coupled receptor kinase 6	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT2574	Individual Protein	Insulin receptor	Homo sapiens	Residual Activity	=	99.0	%	PMID[448608]
NPT3242	Individual Protein	LIM domain kinase 1	Homo sapiens	Residual Activity	=	87.0	%	PMID[448608]
NPT3279	Individual Protein	Serine/threonine-protein kinase 11	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT3381	Individual Protein	Misshapen-like kinase 1	Homo sapiens	Residual Activity	=	75.0	%	PMID[448608]
NPT3332	Individual Protein	Serine/threonine-protein kinase 24	Homo sapiens	Residual Activity	=	73.0	%	PMID[448608]
NPT3247	Individual Protein	Serine/threonine-protein kinase PAK 3	Homo sapiens	Residual Activity	=	72.0	%	PMID[448608]
NPT3247	Individual Protein	Serine/threonine-protein kinase PAK 3	Homo sapiens	Residual Activity	=	83.0	%	PMID[448608]
NPT3206	Individual Protein	Serine/threonine-protein kinase Aurora-C	Homo sapiens	Residual Activity	=	90.0	%	PMID[448608]
NPT1659	Individual Protein	Tyrosine-protein kinase receptor UFO	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT1682	Individual Protein	Dual specificity protein kinase CLK2	Homo sapiens	Residual Activity	=	120.0	%	PMID[448608]
NPT3303	Individual Protein	Discoidin domain-containing receptor 2	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT3212	Individual Protein	Ephrin type-B receptor 1	Homo sapiens	Residual Activity	=	89.0	%	PMID[448608]
NPT4088	Individual Protein	G protein-coupled receptor kinase 6	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT2574	Individual Protein	Insulin receptor	Homo sapiens	Residual Activity	=	84.0	%	PMID[448608]
NPT3279	Individual Protein	Serine/threonine-protein kinase 11	Homo sapiens	Residual Activity	=	90.0	%	PMID[448608]
NPT1691	Individual Protein	Dual specificity mitogen-activated protein kinase kinase 6	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT1691	Individual Protein	Dual specificity mitogen-activated protein kinase kinase 6	Homo sapiens	Residual Activity	=	130.0	%	PMID[448608]
NPT3320	Individual Protein	Proto-oncogene tyrosine-protein kinase MER	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT3245	Individual Protein	Tyrosine kinase non-receptor protein 2	Homo sapiens	Residual Activity	=	84.0	%	PMID[448608]
NPT3245	Individual Protein	Tyrosine kinase non-receptor protein 2	Homo sapiens	Residual Activity	=	68.0	%	PMID[448608]
NPT1659	Individual Protein	Tyrosine-protein kinase receptor UFO	Homo sapiens	Residual Activity	=	44.0	%	PMID[448608]
NPT1682	Individual Protein	Dual specificity protein kinase CLK2	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT1683	Individual Protein	Dual specificity protein kinase CLK3	Homo sapiens	Residual Activity	=	74.0	%	PMID[448608]
NPT3303	Individual Protein	Discoidin domain-containing receptor 2	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT1688	Individual Protein	Myotonin-protein kinase	Homo sapiens	Residual Activity	=	111.0	%	PMID[448608]
NPT3212	Individual Protein	Ephrin type-B receptor 1	Homo sapiens	Residual Activity	=	91.0	%	PMID[448608]
NPT2941	Individual Protein	Ephrin type-B receptor 2	Homo sapiens	Residual Activity	=	121.0	%	PMID[448608]
NPT3438	Individual Protein	G protein-coupled receptor kinase 7	Homo sapiens	Residual Activity	=	99.0	%	PMID[448608]
NPT3438	Individual Protein	G protein-coupled receptor kinase 7	Homo sapiens	Residual Activity	=	91.0	%	PMID[448608]
NPT3386	Individual Protein	Interleukin-1 receptor-associated kinase 1	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT3386	Individual Protein	Interleukin-1 receptor-associated kinase 1	Homo sapiens	Residual Activity	=	83.0	%	PMID[448608]
NPT1707	Individual Protein	Serine/threonine-protein kinase 10	Homo sapiens	Residual Activity	=	100.0	%	PMID[448608]
NPT1707	Individual Protein	Serine/threonine-protein kinase 10	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT3441	Individual Protein	Dual specificity mitogen-activated protein kinase kinase 7	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT3320	Individual Protein	Proto-oncogene tyrosine-protein kinase MER	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT1337	Individual Protein	Hepatocyte growth factor receptor	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT1661	Individual Protein	ALK tyrosine kinase receptor	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3215	Individual Protein	Tyrosine-protein kinase BRK	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT3215	Individual Protein	Tyrosine-protein kinase BRK	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT1683	Individual Protein	Dual specificity protein kinase CLK3	Homo sapiens	Residual Activity	=	80.0	%	PMID[448608]
NPT1688	Individual Protein	Myotonin-protein kinase	Homo sapiens	Residual Activity	=	126.0	%	PMID[448608]
NPT3425	Individual Protein	Interleukin-1 receptor-associated kinase 4	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT13	Individual Protein	Tyrosine-protein kinase LCK	Homo sapiens	Residual Activity	=	114.0	%	PMID[448608]
NPT3441	Individual Protein	Dual specificity mitogen-activated protein kinase kinase 7	Homo sapiens	Residual Activity	=	71.0	%	PMID[448608]
NPT2626	Individual Protein	Myosin light chain kinase, smooth muscle	Homo sapiens	Residual Activity	=	78.0	%	PMID[448608]
NPT1337	Individual Protein	Hepatocyte growth factor receptor	Homo sapiens	Residual Activity	=	85.0	%	PMID[448608]
NPT1661	Individual Protein	ALK tyrosine kinase receptor	Homo sapiens	Residual Activity	=	65.0	%	PMID[448608]
NPT3293	Individual Protein	Activin receptor type-1B	Homo sapiens	Residual Activity	=	132.0	%	PMID[448608]
NPT3113	Individual Protein	Tyrosine-protein kinase CSK	Homo sapiens	Residual Activity	=	115.0	%	PMID[448608]
NPT3113	Individual Protein	Tyrosine-protein kinase CSK	Homo sapiens	Residual Activity	=	95.0	%	PMID[448608]
NPT1709	Individual Protein	Serine/threonine-protein kinase 17A	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT1709	Individual Protein	Serine/threonine-protein kinase 17A	Homo sapiens	Residual Activity	=	77.0	%	PMID[448608]
NPT3359	Individual Protein	Ephrin type-B receptor 3	Homo sapiens	Residual Activity	=	126.0	%	PMID[448608]
NPT3359	Individual Protein	Ephrin type-B receptor 3	Homo sapiens	Residual Activity	=	133.0	%	PMID[448608]
NPT1437	Individual Protein	Tyrosine-protein kinase FES	Homo sapiens	Residual Activity	=	121.0	%	PMID[448608]
NPT591	Individual Protein	Glycogen synthase kinase-3 beta	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT3425	Individual Protein	Interleukin-1 receptor-associated kinase 4	Homo sapiens	Residual Activity	=	83.0	%	PMID[448608]
NPT3286	Individual Protein	Insulin receptor-related protein	Homo sapiens	Residual Activity	=	130.0	%	PMID[448608]
NPT13	Individual Protein	Tyrosine-protein kinase LCK	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT13	Individual Protein	Tyrosine-protein kinase LCK	Homo sapiens	Residual Activity	=	80.0	%	PMID[448608]
NPT2626	Individual Protein	Myosin light chain kinase, smooth muscle	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT3213	Individual Protein	MAP kinase signal-integrating kinase 2	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT3213	Individual Protein	MAP kinase signal-integrating kinase 2	Homo sapiens	Residual Activity	=	82.0	%	PMID[448608]
NPT3293	Individual Protein	Activin receptor type-1B	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT3312	Individual Protein	Tyrosine-protein kinase BLK	Homo sapiens	Residual Activity	=	114.0	%	PMID[448608]
NPT3232	Individual Protein	CaM kinase I alpha	Homo sapiens	Residual Activity	=	109.0	%	PMID[448608]
NPT3399	Individual Protein	Dual-specificity tyrosine-phosphorylation regulated kinase 2	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT2572	Individual Protein	Ephrin type-B receptor 4	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT1437	Individual Protein	Tyrosine-protein kinase FES	Homo sapiens	Residual Activity	=	76.0	%	PMID[448608]
NPT591	Individual Protein	Glycogen synthase kinase-3 beta	Homo sapiens	Residual Activity	=	83.0	%	PMID[448608]
NPT3286	Individual Protein	Insulin receptor-related protein	Homo sapiens	Residual Activity	=	76.0	%	PMID[448608]
NPT13	Individual Protein	Tyrosine-protein kinase LCK	Homo sapiens	Residual Activity	=	79.0	%	PMID[448608]
NPT3326	Individual Protein	Mitogen-activated protein kinase kinase kinase 9	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT3333	Individual Protein	Muscle, skeletal receptor tyrosine protein kinase	Homo sapiens	Residual Activity	=	114.0	%	PMID[448608]
NPT3312	Individual Protein	Tyrosine-protein kinase BLK	Homo sapiens	Residual Activity	=	90.0	%	PMID[448608]
NPT1608	Individual Protein	Serine/threonine-protein kinase Chk1	Homo sapiens	Residual Activity	=	86.0	%	PMID[448608]
NPT3232	Individual Protein	CaM kinase I alpha	Homo sapiens	Residual Activity	=	86.0	%	PMID[448608]
NPT1630	Individual Protein	CaM kinase II beta	Homo sapiens	Residual Activity	=	80.0	%	PMID[448608]
NPT3399	Individual Protein	Dual-specificity tyrosine-phosphorylation regulated kinase 2	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT285	Individual Protein	Epidermal growth factor receptor erbB1	Homo sapiens	Residual Activity	=	117.0	%	PMID[448608]
NPT2572	Individual Protein	Ephrin type-B receptor 4	Homo sapiens	Residual Activity	=	119.0	%	PMID[448608]
NPT3112	Individual Protein	Tyrosine-protein kinase FGR	Homo sapiens	Residual Activity	=	116.0	%	PMID[448608]
NPT3112	Individual Protein	Tyrosine-protein kinase FGR	Homo sapiens	Residual Activity	=	77.0	%	PMID[448608]
NPT3444	Individual Protein	Homeodomain-interacting protein kinase 1	Homo sapiens	Residual Activity	=	95.0	%	PMID[448608]
NPT3444	Individual Protein	Homeodomain-interacting protein kinase 1	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT1439	Individual Protein	Tyrosine-protein kinase ITK/TSK	Homo sapiens	Residual Activity	=	99.0	%	PMID[448608]
NPT1439	Individual Protein	Tyrosine-protein kinase ITK/TSK	Homo sapiens	Residual Activity	=	91.0	%	PMID[448608]
NPT3111	Individual Protein	Tyrosine-protein kinase Lyn	Homo sapiens	Residual Activity	=	83.0	%	PMID[448608]
NPT3111	Individual Protein	Tyrosine-protein kinase Lyn	Homo sapiens	Residual Activity	=	65.0	%	PMID[448608]
NPT3326	Individual Protein	Mitogen-activated protein kinase kinase kinase 9	Homo sapiens	Residual Activity	=	81.0	%	PMID[448608]
NPT3329	Individual Protein	Serine/threonine-protein kinase MRCK-A	Homo sapiens	Residual Activity	=	85.0	%	PMID[448608]
NPT3333	Individual Protein	Muscle, skeletal receptor tyrosine protein kinase	Homo sapiens	Residual Activity	=	95.0	%	PMID[448608]
NPT3443	Individual Protein	Serine/threonine-protein kinase Nek11	Homo sapiens	Residual Activity	=	104.0	%	PMID[448608]
NPT2750	Individual Protein	Tyrosine-protein kinase BMX	Homo sapiens	Residual Activity	=	89.0	%	PMID[448608]
NPT2750	Individual Protein	Tyrosine-protein kinase BMX	Homo sapiens	Residual Activity	=	79.0	%	PMID[448608]
NPT1608	Individual Protein	Serine/threonine-protein kinase Chk1	Homo sapiens	Residual Activity	=	99.0	%	PMID[448608]
NPT1630	Individual Protein	CaM kinase II beta	Homo sapiens	Residual Activity	=	55.0	%	PMID[448608]
NPT285	Individual Protein	Epidermal growth factor receptor erbB1	Homo sapiens	Residual Activity	=	104.0	%	PMID[448608]
NPT1435	Individual Protein	Receptor protein-tyrosine kinase erbB-4	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT1435	Individual Protein	Receptor protein-tyrosine kinase erbB-4	Homo sapiens	Residual Activity	=	79.0	%	PMID[448608]
NPT301	Individual Protein	Vascular endothelial growth factor receptor 1	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT3432	Individual Protein	Homeodomain-interacting protein kinase 2	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT3246	Individual Protein	Tyrosine-protein kinase JAK2	Homo sapiens	Residual Activity	=	80.0	%	PMID[448608]
NPT281	Individual Protein	MAP kinase ERK1	Homo sapiens	Residual Activity	=	104.0	%	PMID[448608]
NPT3329	Individual Protein	Serine/threonine-protein kinase MRCK-A	Homo sapiens	Residual Activity	=	84.0	%	PMID[448608]
NPT3443	Individual Protein	Serine/threonine-protein kinase Nek11	Homo sapiens	Residual Activity	=	113.0	%	PMID[448608]
NPT1660	Individual Protein	NUAK family SNF1-like kinase 1	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT3315	Individual Protein	BR serine/threonine-protein kinase 1	Homo sapiens	Residual Activity	=	47.0	%	PMID[448608]
NPT1680	Individual Protein	Serine/threonine-protein kinase Chk2	Homo sapiens	Residual Activity	=	73.0	%	PMID[448608]
NPT1680	Individual Protein	Serine/threonine-protein kinase Chk2	Homo sapiens	Residual Activity	=	90.0	%	PMID[448608]
NPT1676	Individual Protein	CaM kinase II gamma	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT1676	Individual Protein	CaM kinase II gamma	Homo sapiens	Residual Activity	=	70.0	%	PMID[448608]
NPT3354	Individual Protein	Ephrin type-A receptor 1	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT3354	Individual Protein	Ephrin type-A receptor 1	Homo sapiens	Residual Activity	=	106.0	%	PMID[448608]
NPT1436	Individual Protein	Focal adhesion kinase 1	Homo sapiens	Residual Activity	=	140.0	%	PMID[448608]
NPT301	Individual Protein	Vascular endothelial growth factor receptor 1	Homo sapiens	Residual Activity	=	47.0	%	PMID[448608]
NPT1650	Individual Protein	Tyrosine-protein kinase receptor FLT3	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3432	Individual Protein	Homeodomain-interacting protein kinase 2	Homo sapiens	Residual Activity	=	86.0	%	PMID[448608]
NPT3409	Individual Protein	Homeodomain-interacting protein kinase 3	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT3246	Individual Protein	Tyrosine-protein kinase JAK2	Homo sapiens	Residual Activity	=	121.0	%	PMID[448608]
NPT1440	Individual Protein	Tyrosine-protein kinase JAK3	Homo sapiens	Residual Activity	=	91.0	%	PMID[448608]
NPT281	Individual Protein	MAP kinase ERK1	Homo sapiens	Residual Activity	=	81.0	%	PMID[448608]
NPT282	Individual Protein	MAP kinase ERK2	Homo sapiens	Residual Activity	=	112.0	%	PMID[448608]
NPT3330	Individual Protein	Serine/threonine-protein kinase MRCK beta	Homo sapiens	Residual Activity	=	90.0	%	PMID[448608]
NPT3330	Individual Protein	Serine/threonine-protein kinase MRCK beta	Homo sapiens	Residual Activity	=	81.0	%	PMID[448608]
NPT1658	Individual Protein	Serine/threonine-protein kinase NEK2	Homo sapiens	Residual Activity	=	76.0	%	PMID[448608]
NPT1658	Individual Protein	Serine/threonine-protein kinase NEK2	Homo sapiens	Residual Activity	=	68.0	%	PMID[448608]
NPT1660	Individual Protein	NUAK family SNF1-like kinase 1	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT1431	Individual Protein	Mitogen-activated protein kinase kinase kinase 5	Homo sapiens	Residual Activity	=	117.0	%	PMID[448608]
NPT3315	Individual Protein	BR serine/threonine-protein kinase 1	Homo sapiens	Residual Activity	=	48.0	%	PMID[448608]
NPT3344	Individual Protein	BR serine/threonine-protein kinase 2	Homo sapiens	Residual Activity	=	108.0	%	PMID[448608]
NPT1684	Individual Protein	Casein kinase I gamma 1	Homo sapiens	Residual Activity	=	80.0	%	PMID[448608]
NPT1675	Individual Protein	CaM kinase II delta	Homo sapiens	Residual Activity	=	108.0	%	PMID[448608]
NPT3225	Individual Protein	Ephrin type-A receptor 2	Homo sapiens	Residual Activity	=	115.0	%	PMID[448608]
NPT1436	Individual Protein	Focal adhesion kinase 1	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT1480	Individual Protein	Fibroblast growth factor receptor 1	Homo sapiens	Residual Activity	=	85.0	%	PMID[448608]
NPT1650	Individual Protein	Tyrosine-protein kinase receptor FLT3	Homo sapiens	Residual Activity	=	75.0	%	PMID[448608]
NPT3409	Individual Protein	Homeodomain-interacting protein kinase 3	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT1440	Individual Protein	Tyrosine-protein kinase JAK3	Homo sapiens	Residual Activity	=	67.0	%	PMID[448608]
NPT282	Individual Protein	MAP kinase ERK2	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT1613	Individual Protein	Ribosomal protein S6 kinase alpha 5	Homo sapiens	Residual Activity	=	130.0	%	PMID[448608]
NPT3391	Individual Protein	Serine/threonine-protein kinase Nek3	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT1431	Individual Protein	Mitogen-activated protein kinase kinase kinase 5	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT3344	Individual Protein	BR serine/threonine-protein kinase 2	Homo sapiens	Residual Activity	=	67.0	%	PMID[448608]
NPT1684	Individual Protein	Casein kinase I gamma 1	Homo sapiens	Residual Activity	=	71.0	%	PMID[448608]
NPT1685	Individual Protein	Casein kinase I gamma 2	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT1675	Individual Protein	CaM kinase II delta	Homo sapiens	Residual Activity	=	85.0	%	PMID[448608]
NPT1677	Individual Protein	CaM kinase IV	Homo sapiens	Residual Activity	=	114.0	%	PMID[448608]
NPT3225	Individual Protein	Ephrin type-A receptor 2	Homo sapiens	Residual Activity	=	100.0	%	PMID[448608]
NPT3217	Individual Protein	Ephrin type-A receptor 3	Homo sapiens	Residual Activity	=	115.0	%	PMID[448608]
NPT1480	Individual Protein	Fibroblast growth factor receptor 1	Homo sapiens	Residual Activity	=	44.0	%	PMID[448608]
NPT2573	Individual Protein	Vascular endothelial growth factor receptor 3	Homo sapiens	Residual Activity	=	85.0	%	PMID[448608]
NPT2573	Individual Protein	Vascular endothelial growth factor receptor 3	Homo sapiens	Residual Activity	=	62.0	%	PMID[448608]
NPT4093	Individual Protein	Serine/threonine-protein kinase haspin	Homo sapiens	Residual Activity	=	109.0	%	PMID[448608]
NPT4093	Individual Protein	Serine/threonine-protein kinase haspin	Homo sapiens	Residual Activity	=	69.0	%	PMID[448608]
NPT1426	Individual Protein	c-Jun N-terminal kinase 1	Homo sapiens	Residual Activity	=	100.0	%	PMID[448608]
NPT1426	Individual Protein	c-Jun N-terminal kinase 1	Homo sapiens	Residual Activity	=	64.0	%	PMID[448608]
NPT1441	Individual Protein	MAP kinase-activated protein kinase 2	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT1613	Individual Protein	Ribosomal protein S6 kinase alpha 5	Homo sapiens	Residual Activity	=	112.0	%	PMID[448608]
NPT3374	Individual Protein	Ribosomal protein S6 kinase alpha 4	Homo sapiens	Residual Activity	=	105.0	%	PMID[448608]
NPT3391	Individual Protein	Serine/threonine-protein kinase Nek3	Homo sapiens	Residual Activity	=	60.0	%	PMID[448608]
NPT1657	Individual Protein	Serine/threonine-protein kinase NEK6	Homo sapiens	Residual Activity	=	98.0	%	PMID[448608]
NPT2729	Individual Protein	Tyrosine-protein kinase ABL	Homo sapiens	Residual Activity	=	85.0	%	PMID[448608]
NPT2729	Individual Protein	Tyrosine-protein kinase ABL	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT1685	Individual Protein	Casein kinase I gamma 2	Homo sapiens	Residual Activity	=	87.0	%	PMID[448608]
NPT1677	Individual Protein	CaM kinase IV	Homo sapiens	Residual Activity	=	69.0	%	PMID[448608]
NPT3217	Individual Protein	Ephrin type-A receptor 3	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT1481	Individual Protein	Fibroblast growth factor receptor 2	Homo sapiens	Residual Activity	=	105.0	%	PMID[448608]
NPT1481	Individual Protein	Fibroblast growth factor receptor 2	Homo sapiens	Residual Activity	=	98.0	%	PMID[448608]
NPT3267	Individual Protein	Macrophage colony stimulating factor receptor	Homo sapiens	Residual Activity	=	87.0	%	PMID[448608]
NPT1438	Individual Protein	Insulin-like growth factor I receptor	Homo sapiens	Residual Activity	=	82.0	%	PMID[448608]
NPT1427	Individual Protein	c-Jun N-terminal kinase 2	Homo sapiens	Residual Activity	=	112.0	%	PMID[448608]
NPT3461	Individual Protein	MAP kinase-activated protein kinase 3	Homo sapiens	Residual Activity	=	99.0	%	PMID[448608]
NPT3374	Individual Protein	Ribosomal protein S6 kinase alpha 4	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT1657	Individual Protein	Serine/threonine-protein kinase NEK6	Homo sapiens	Residual Activity	=	68.0	%	PMID[448608]
NPT3214	Individual Protein	Tyrosine-protein kinase ABL2	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT1686	Individual Protein	Casein kinase I isoform gamma-3	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT1686	Individual Protein	Casein kinase I isoform gamma-3	Homo sapiens	Residual Activity	=	72.0	%	PMID[448608]
NPT1672	Individual Protein	CaM kinase I delta	Homo sapiens	Residual Activity	=	106.0	%	PMID[448608]
NPT1672	Individual Protein	CaM kinase I delta	Homo sapiens	Residual Activity	=	75.0	%	PMID[448608]
NPT3218	Individual Protein	Ephrin type-A receptor 4	Homo sapiens	Residual Activity	=	113.0	%	PMID[448608]
NPT3218	Individual Protein	Ephrin type-A receptor 4	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT3227	Individual Protein	Fibroblast growth factor receptor 3	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT3267	Individual Protein	Macrophage colony stimulating factor receptor	Homo sapiens	Residual Activity	=	74.0	%	PMID[448608]
NPT14	Individual Protein	Tyrosine-protein kinase FYN	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3205	Individual Protein	Tyrosine-protein kinase HCK	Homo sapiens	Residual Activity	=	60.0	%	PMID[448608]
NPT3205	Individual Protein	Tyrosine-protein kinase HCK	Homo sapiens	Residual Activity	=	95.0	%	PMID[448608]
NPT1427	Individual Protein	c-Jun N-terminal kinase 2	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3207	Individual Protein	c-Jun N-terminal kinase 3	Homo sapiens	Residual Activity	=	81.0	%	PMID[448608]
NPT3461	Individual Protein	MAP kinase-activated protein kinase 3	Homo sapiens	Residual Activity	=	53.0	%	PMID[448608]
NPT3317	Individual Protein	Serine/threonine-protein kinase MARK1	Homo sapiens	Residual Activity	=	98.0	%	PMID[448608]
NPT1703	Individual Protein	cAMP-dependent protein kinase alpha-catalytic subunit	Homo sapiens	Residual Activity	=	98.0	%	PMID[448608]
NPT1700	Individual Protein	Serine/threonine-protein kinase PIM2	Homo sapiens	Residual Activity	=	88.0	%	PMID[448608]
NPT1701	Individual Protein	Serine/threonine-protein kinase PIM3	Homo sapiens	Residual Activity	=	100.0	%	PMID[448608]
NPT3277	Individual Protein	Tyrosine-protein kinase receptor TYRO3	Homo sapiens	Residual Activity	=	79.0	%	PMID[448608]
NPT3106	Individual Protein	Ribosomal protein S6 kinase alpha 1	Homo sapiens	Residual Activity	=	108.0	%	PMID[448608]
NPT3349	Individual Protein	Serine/threonine-protein kinase SIK1	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT3269	Individual Protein	Serine/threonine-protein kinase tousled-like 2	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT4094	Individual Protein	Serine/threonine-protein kinase WNK3	Homo sapiens	Residual Activity	=	117.0	%	PMID[448608]
NPT4094	Individual Protein	Serine/threonine-protein kinase WNK3	Homo sapiens	Residual Activity	=	84.0	%	PMID[448608]
NPT1703	Individual Protein	cAMP-dependent protein kinase alpha-catalytic subunit	Homo sapiens	Residual Activity	=	73.0	%	PMID[448608]
NPT3394	Individual Protein	Protein kinase C iota	Homo sapiens	Residual Activity	=	98.0	%	PMID[448608]
NPT1701	Individual Protein	Serine/threonine-protein kinase PIM3	Homo sapiens	Residual Activity	=	95.0	%	PMID[448608]
NPT3106	Individual Protein	Ribosomal protein S6 kinase alpha 1	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3291	Individual Protein	Serine/threonine-protein kinase SRPK1	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT3291	Individual Protein	Serine/threonine-protein kinase SRPK1	Homo sapiens	Residual Activity	=	98.0	%	PMID[448608]
NPT3299	Individual Protein	Testis-specific serine/threonine-protein kinase 1	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT3299	Individual Protein	Testis-specific serine/threonine-protein kinase 1	Homo sapiens	Residual Activity	=	105.0	%	PMID[448608]
NPT1663	Individual Protein	Tyrosine-protein kinase YES	Homo sapiens	Residual Activity	=	105.0	%	PMID[448608]
NPT3394	Individual Protein	Protein kinase C iota	Homo sapiens	Residual Activity	=	81.0	%	PMID[448608]
NPT1705	Individual Protein	Ribosomal protein S6 kinase alpha 3	Homo sapiens	Residual Activity	=	115.0	%	PMID[448608]
NPT1705	Individual Protein	Ribosomal protein S6 kinase alpha 3	Homo sapiens	Residual Activity	=	91.0	%	PMID[448608]
NPT3292	Individual Protein	Serine/threonine-protein kinase SRPK2	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT3462	Individual Protein	Testis-specific serine/threonine-protein kinase 2	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT1663	Individual Protein	Tyrosine-protein kinase YES	Homo sapiens	Residual Activity	=	84.0	%	PMID[448608]
NPT3259	Individual Protein	Tyrosine-protein kinase ZAP-70	Homo sapiens	Residual Activity	=	119.0	%	PMID[448608]
NPT1430	Individual Protein	Serine/threonine-protein kinase AKT2	Homo sapiens	Residual Activity	=	90.0	%	PMID[448608]
NPT1430	Individual Protein	Serine/threonine-protein kinase AKT2	Homo sapiens	Residual Activity	=	53.0	%	PMID[448608]
NPT3364	Individual Protein	Protein kinase C mu	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT3364	Individual Protein	Protein kinase C mu	Homo sapiens	Residual Activity	=	61.0	%	PMID[448608]
NPT3358	Individual Protein	Serine/threonine-protein kinase PLK3	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT3234	Individual Protein	Ribosomal protein S6 kinase alpha 2	Homo sapiens	Residual Activity	=	104.0	%	PMID[448608]
NPT3296	Individual Protein	Serine/threonine-protein kinase 33	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT3462	Individual Protein	Testis-specific serine/threonine-protein kinase 2	Homo sapiens	Residual Activity	=	108.0	%	PMID[448608]
NPT3351	Individual Protein	Tyrosine-protein kinase TEC	Homo sapiens	Residual Activity	=	86.0	%	PMID[448608]
NPT3259	Individual Protein	Tyrosine-protein kinase ZAP-70	Homo sapiens	Residual Activity	=	95.0	%	PMID[448608]
NPT2546	Individual Protein	Serine/threonine-protein kinase AKT3	Homo sapiens	Residual Activity	=	82.0	%	PMID[448608]
NPT3365	Individual Protein	Serine/threonine-protein kinase D2	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT3358	Individual Protein	Serine/threonine-protein kinase PLK3	Homo sapiens	Residual Activity	=	77.0	%	PMID[448608]
NPT3262	Individual Protein	Serine/threonine-protein kinase PRKX	Homo sapiens	Residual Activity	=	104.0	%	PMID[448608]
NPT3234	Individual Protein	Ribosomal protein S6 kinase alpha 2	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT3254	Individual Protein	Ribosomal protein S6 kinase alpha 6	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT3296	Individual Protein	Serine/threonine-protein kinase 33	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3351	Individual Protein	Tyrosine-protein kinase TEC	Homo sapiens	Residual Activity	=	66.0	%	PMID[448608]
NPT1687	Individual Protein	Death-associated protein kinase 3	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT1687	Individual Protein	Death-associated protein kinase 3	Homo sapiens	Residual Activity	=	115.0	%	PMID[448608]
NPT1695	Individual Protein	Serine/threonine-protein kinase PAK 4	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT2546	Individual Protein	Serine/threonine-protein kinase AKT3	Homo sapiens	Residual Activity	=	63.0	%	PMID[448608]
NPT182	Individual Protein	Protein kinase C alpha	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT3365	Individual Protein	Serine/threonine-protein kinase D2	Homo sapiens	Residual Activity	=	114.0	%	PMID[448608]
NPT3262	Individual Protein	Serine/threonine-protein kinase PRKX	Homo sapiens	Residual Activity	=	81.0	%	PMID[448608]
NPT3254	Individual Protein	Ribosomal protein S6 kinase alpha 6	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT3414	Individual Protein	Serine/threonine-protein kinase PLK2	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT3414	Individual Protein	Serine/threonine-protein kinase PLK2	Homo sapiens	Residual Activity	=	71.0	%	PMID[448608]
NPT2576	Individual Protein	Tyrosine-protein kinase TIE-2	Homo sapiens	Residual Activity	=	12.0	%	PMID[448608]
NPT2576	Individual Protein	Tyrosine-protein kinase TIE-2	Homo sapiens	Residual Activity	=	3.0	%	PMID[448608]
NPT1424	Individual Protein	Serine/threonine-protein kinase RAF	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT1695	Individual Protein	Serine/threonine-protein kinase PAK 4	Homo sapiens	Residual Activity	=	100.0	%	PMID[448608]
NPT1696	Individual Protein	Serine/threonine-protein kinase PAK7	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT182	Individual Protein	Protein kinase C alpha	Homo sapiens	Residual Activity	=	100.0	%	PMID[448608]
NPT3367	Individual Protein	cGMP-dependent protein kinase 1 beta	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT3367	Individual Protein	cGMP-dependent protein kinase 1 beta	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3263	Individual Protein	Protein tyrosine kinase 2 beta	Homo sapiens	Residual Activity	=	133.0	%	PMID[448608]
NPT3263	Individual Protein	Protein tyrosine kinase 2 beta	Homo sapiens	Residual Activity	=	89.0	%	PMID[448608]
NPT283	Individual Protein	MAP kinase p38 alpha	Homo sapiens	Residual Activity	=	106.0	%	PMID[448608]
NPT283	Individual Protein	MAP kinase p38 alpha	Homo sapiens	Residual Activity	=	115.0	%	PMID[448608]
NPT1449	Individual Protein	Tyrosine-protein kinase SYK	Homo sapiens	Residual Activity	=	132.0	%	PMID[448608]
NPT3239	Individual Protein	Nerve growth factor receptor Trk-A	Homo sapiens	Residual Activity	=	113.0	%	PMID[448608]
NPT1424	Individual Protein	Serine/threonine-protein kinase RAF	Homo sapiens	Residual Activity	=	100.0	%	PMID[448608]
NPT1479	Individual Protein	Stem cell growth factor receptor	Homo sapiens	Residual Activity	=	123.0	%	PMID[448608]
NPT1696	Individual Protein	Serine/threonine-protein kinase PAK7	Homo sapiens	Residual Activity	=	87.0	%	PMID[448608]
NPT1447	Individual Protein	Serine/threonine-protein kinase RIPK2	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT1616	Individual Protein	MAP kinase p38 beta	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT1449	Individual Protein	Tyrosine-protein kinase SYK	Homo sapiens	Residual Activity	=	82.0	%	PMID[448608]
NPT3442	Individual Protein	Mitogen-activated protein kinase kinase kinase 7	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3239	Individual Protein	Nerve growth factor receptor Trk-A	Homo sapiens	Residual Activity	=	108.0	%	PMID[448608]
NPT3270	Individual Protein	Neurotrophic tyrosine kinase receptor type 2	Homo sapiens	Residual Activity	=	106.0	%	PMID[448608]
NPT1479	Individual Protein	Stem cell growth factor receptor	Homo sapiens	Residual Activity	=	95.0	%	PMID[448608]
NPT1697	Individual Protein	Serine/threonine-protein kinase PAK6	Homo sapiens	Residual Activity	=	99.0	%	PMID[448608]
NPT1697	Individual Protein	Serine/threonine-protein kinase PAK6	Homo sapiens	Residual Activity	=	61.0	%	PMID[448608]
NPT3367	Individual Protein	cGMP-dependent protein kinase 1 beta	Homo sapiens	Residual Activity	=	87.0	%	PMID[448608]
NPT1612	Individual Protein	MAP kinase-activated protein kinase 5	Homo sapiens	Residual Activity	=	84.0	%	PMID[448608]
NPT1447	Individual Protein	Serine/threonine-protein kinase RIPK2	Homo sapiens	Residual Activity	=	88.0	%	PMID[448608]
NPT592	Individual Protein	Rho-associated protein kinase 1	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT1616	Individual Protein	MAP kinase p38 beta	Homo sapiens	Residual Activity	=	105.0	%	PMID[448608]
NPT1615	Individual Protein	MAP kinase p38 gamma	Homo sapiens	Residual Activity	=	105.0	%	PMID[448608]
NPT3442	Individual Protein	Mitogen-activated protein kinase kinase kinase 7	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT3270	Individual Protein	Neurotrophic tyrosine kinase receptor type 2	Homo sapiens	Residual Activity	=	81.0	%	PMID[448608]
NPT36	Individual Protein	Tyrosine-protein kinase SRC	Homo sapiens	Residual Activity	=	74.0	%	PMID[448608]
NPT36	Individual Protein	Tyrosine-protein kinase SRC	Homo sapiens	Residual Activity	=	69.0	%	PMID[448608]
NPT3235	Individual Protein	MAP/microtubule affinity-regulating kinase 2	Homo sapiens	Residual Activity	=	90.0	%	PMID[448608]
NPT1612	Individual Protein	MAP kinase-activated protein kinase 5	Homo sapiens	Residual Activity	=	52.0	%	PMID[448608]
NPT592	Individual Protein	Rho-associated protein kinase 1	Homo sapiens	Residual Activity	=	120.0	%	PMID[448608]
NPT1615	Individual Protein	MAP kinase p38 gamma	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT3431	Individual Protein	Serine/threonine-protein kinase TAO1	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT3431	Individual Protein	Serine/threonine-protein kinase TAO1	Homo sapiens	Residual Activity	=	87.0	%	PMID[448608]
NPT3272	Individual Protein	Tyrosine-protein kinase TXK	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT3272	Individual Protein	Tyrosine-protein kinase TXK	Homo sapiens	Residual Activity	=	59.0	%	PMID[448608]
NPT1344	Individual Protein	Serine/threonine-protein kinase EEF2K	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT3235	Individual Protein	MAP/microtubule affinity-regulating kinase 2	Homo sapiens	Residual Activity	=	108.0	%	PMID[448608]
NPT3357	Individual Protein	Protein kinase N2	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT3357	Individual Protein	Protein kinase N2	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3107	Individual Protein	Rho-associated protein kinase 2	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT3107	Individual Protein	Rho-associated protein kinase 2	Homo sapiens	Residual Activity	=	82.0	%	PMID[448608]
NPT1614	Individual Protein	MAP kinase p38 delta	Homo sapiens	Residual Activity	=	112.0	%	PMID[448608]
NPT3426	Individual Protein	Serine/threonine-protein kinase TAO2	Homo sapiens	Residual Activity	=	105.0	%	PMID[448608]
NPT3422	Individual Protein	Serine/threonine-protein kinase ULK2	Homo sapiens	Residual Activity	=	104.0	%	PMID[448608]
NPT1344	Individual Protein	Serine/threonine-protein kinase EEF2K	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT3454	Individual Protein	PAS domain-containing serine/threonine-protein kinase	Homo sapiens	Residual Activity	=	70.0	%	PMID[448608]
NPT3454	Individual Protein	PAS domain-containing serine/threonine-protein kinase	Homo sapiens	Residual Activity	=	61.0	%	PMID[448608]
NPT3204	Individual Protein	Tyrosine-protein kinase FRK	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT3370	Individual Protein	Tyrosine-protein kinase receptor RET	Homo sapiens	Residual Activity	=	86.0	%	PMID[448608]
NPT1614	Individual Protein	MAP kinase p38 delta	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT1448	Individual Protein	Serine/threonine-protein kinase Sgk1	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT3426	Individual Protein	Serine/threonine-protein kinase TAO2	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT3427	Individual Protein	Serine/threonine-protein kinase TAO3	Homo sapiens	Residual Activity	=	99.0	%	PMID[448608]
NPT3422	Individual Protein	Serine/threonine-protein kinase ULK2	Homo sapiens	Residual Activity	=	94.0	%	PMID[448608]
NPT3382	Individual Protein	Serine/threonine-protein kinase ULK3	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT3020	Individual Protein	Platelet-derived growth factor receptor alpha	Homo sapiens	Residual Activity	=	113.0	%	PMID[448608]
NPT3204	Individual Protein	Tyrosine-protein kinase FRK	Homo sapiens	Residual Activity	=	69.0	%	PMID[448608]
NPT3223	Individual Protein	Phosphorylase kinase gamma subunit 2	Homo sapiens	Residual Activity	=	111.0	%	PMID[448608]
NPT3370	Individual Protein	Tyrosine-protein kinase receptor RET	Homo sapiens	Residual Activity	=	106.0	%	PMID[448608]
NPT3390	Individual Protein	Macrophage-stimulating protein receptor	Homo sapiens	Residual Activity	=	86.0	%	PMID[448608]
NPT1448	Individual Protein	Serine/threonine-protein kinase Sgk1	Homo sapiens	Residual Activity	=	85.0	%	PMID[448608]
NPT3427	Individual Protein	Serine/threonine-protein kinase TAO3	Homo sapiens	Residual Activity	=	90.0	%	PMID[448608]
NPT3382	Individual Protein	Serine/threonine-protein kinase ULK3	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT3020	Individual Protein	Platelet-derived growth factor receptor alpha	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT2575	Individual Protein	Platelet-derived growth factor receptor beta	Homo sapiens	Residual Activity	=	108.0	%	PMID[448608]
NPT3455	Individual Protein	Protein kinase C zeta	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT3223	Individual Protein	Phosphorylase kinase gamma subunit 2	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT3390	Individual Protein	Macrophage-stimulating protein receptor	Homo sapiens	Residual Activity	=	75.0	%	PMID[448608]
NPT3456	Individual Protein	Serine/threonine-protein kinase Sgk2	Homo sapiens	Residual Activity	=	130.0	%	PMID[448608]
NPT3456	Individual Protein	Serine/threonine-protein kinase Sgk2	Homo sapiens	Residual Activity	=	65.0	%	PMID[448608]
NPT3417	Individual Protein	Serine/threonine-protein kinase TBK1	Homo sapiens	Residual Activity	=	81.0	%	PMID[448608]
NPT3417	Individual Protein	Serine/threonine-protein kinase TBK1	Homo sapiens	Residual Activity	=	65.0	%	PMID[448608]
NPT1715	Individual Protein	Serine/threonine-protein kinase VRK2	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT1715	Individual Protein	Serine/threonine-protein kinase VRK2	Homo sapiens	Residual Activity	=	91.0	%	PMID[448608]
NPT1611	Individual Protein	Ribosomal protein S6 kinase 1	Homo sapiens	Residual Activity	=	130.0	%	PMID[448608]
NPT3455	Individual Protein	Protein kinase C zeta	Homo sapiens	Residual Activity	=	75.0	%	PMID[448608]
NPT1265	Individual Protein	Serine/threonine-protein kinase PIM1	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT3373	Individual Protein	Proto-oncogene tyrosine-protein kinase ROS	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT3373	Individual Protein	Proto-oncogene tyrosine-protein kinase ROS	Homo sapiens	Residual Activity	=	104.0	%	PMID[448608]
NPT3418	Individual Protein	Serine/threonine-protein kinase Sgk3	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT3353	Individual Protein	TGF-beta receptor type I	Homo sapiens	Residual Activity	=	82.0	%	PMID[448608]
NPT4096	Individual Protein	Serine/threonine-protein kinase WNK2	Homo sapiens	Residual Activity	=	114.0	%	PMID[448608]
NPT1611	Individual Protein	Ribosomal protein S6 kinase 1	Homo sapiens	Residual Activity	=	63.0	%	PMID[448608]
NPT1699	Individual Protein	3-phosphoinositide dependent protein kinase-1	Homo sapiens	Residual Activity	=	106.0	%	PMID[448608]
NPT1699	Individual Protein	3-phosphoinositide dependent protein kinase-1	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT3124	Individual Protein	Protein kinase C eta	Homo sapiens	Residual Activity	=	112.0	%	PMID[448608]
NPT3124	Individual Protein	Protein kinase C eta	Homo sapiens	Residual Activity	=	86.0	%	PMID[448608]
NPT1700	Individual Protein	Serine/threonine-protein kinase PIM2	Homo sapiens	Residual Activity	=	86.0	%	PMID[448608]
NPT3277	Individual Protein	Tyrosine-protein kinase receptor TYRO3	Homo sapiens	Residual Activity	=	89.0	%	PMID[448608]
NPT3418	Individual Protein	Serine/threonine-protein kinase Sgk3	Homo sapiens	Residual Activity	=	79.0	%	PMID[448608]
NPT3349	Individual Protein	Serine/threonine-protein kinase SIK1	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT3353	Individual Protein	TGF-beta receptor type I	Homo sapiens	Residual Activity	=	89.0	%	PMID[448608]
NPT3269	Individual Protein	Serine/threonine-protein kinase tousled-like 2	Homo sapiens	Residual Activity	=	95.0	%	PMID[448608]
NPT4096	Individual Protein	Serine/threonine-protein kinase WNK2	Homo sapiens	Residual Activity	=	76.0	%	PMID[448608]
NPT50	Individual Protein	Tyrosyl-DNA phosphodiesterase 1	Homo sapiens	Potency	n.a.	1263.6	nM	PMID[448611]
NPT104	Individual Protein	Cerebroside-sulfatase	Homo sapiens	Potency	n.a.	8492.1	nM	PMID[448600]
NPT49	Individual Protein	DNA-(apurinic or apyrimidinic site) lyase	Homo sapiens	Potency	n.a.	10000.0	nM	PMID[448602]
NPT49	Individual Protein	DNA-(apurinic or apyrimidinic site) lyase	Homo sapiens	Potency	n.a.	25118.9	nM	PMID[448598]
NPT3166	Individual Protein	DOPA decarboxylase	Homo sapiens	IC50	=	1280000.0	nM	PMID[448613]
NPT82	Cell Line	MDA-MB-231	Homo sapiens	Inhibition	=	100.0	%	PMID[448614]
NPT762	Cell Line	A-431	Homo sapiens	Inhibition	=	100.0	%	PMID[448614]
NPT582	Individual Protein	Monoamine oxidase B	Homo sapiens	IC50	>	20000.0	nM	PMID[448616]
NPT261	Individual Protein	Monoamine oxidase A	Homo sapiens	IC50	=	550.0	nM	PMID[448616]
NPT582	Individual Protein	Monoamine oxidase B	Homo sapiens	Activity	=	94.3	%	PMID[448616]
NPT261	Individual Protein	Monoamine oxidase A	Homo sapiens	Activity	=	28.3	%	PMID[448616]
NPT261	Individual Protein	Monoamine oxidase A	Homo sapiens	Ki	=	220.0	nM	PMID[448616]
NPT261	Individual Protein	Monoamine oxidase A	Homo sapiens	Activity	=	75.0	%	PMID[448616]
NPT261	Individual Protein	Monoamine oxidase A	Homo sapiens	Activity	=	28.5	%	PMID[448616]
NPT5536	Individual Protein	Sarcoplasmic/endoplasmic reticulum calcium ATP-ase	Oryctolagus cuniculus	IC50	=	1200.0	nM	PMID[448618]
NPT737	Cell Line	HUVEC	Homo sapiens	IC50	=	4930.0	nM	PMID[448620]
NPT397	Cell Line	NCI-H460	Homo sapiens	IC50	=	5140.0	nM	PMID[448620]
NPT2452	Cell Line	NCI-H292		IC50	=	4960.0	nM	PMID[448620]
NPT2410	Cell Line	NCI-H1299	Homo sapiens	IC50	=	4280.0	nM	PMID[448620]
NPT81	Cell Line	A549	Homo sapiens	IC50	=	7730.0	nM	PMID[448620]
NPT204	Individual Protein	Acetylcholinesterase	Homo sapiens	IC50	=	1450.0	nM	PMID[448622]
NPT439	Individual Protein	Butyrylcholinesterase	Homo sapiens	IC50	=	8580.0	nM	PMID[448622]
NPT204	Individual Protein	Acetylcholinesterase	Homo sapiens	Inhibition	=	76.9	%	PMID[448622]
NPT2	Others	Unspecified		Potency	=	8912.5	nM	PMID[448598]
NPT312	Organism	Saccharomyces cerevisiae	Saccharomyces cerevisiae	Potency	=	5804.8	nM	PMID[448600]
NPT93	Individual Protein	Survival motor neuron protein	Homo sapiens	Potency	=	7079.5	nM	PMID[448601]
NPT94	Individual Protein	Aldehyde dehydrogenase 1A1	Homo sapiens	Potency	=	22387.2	nM	PMID[448598]
NPT94	Individual Protein	Aldehyde dehydrogenase 1A1	Homo sapiens	Potency	=	15848.9	nM	PMID[448601]
NPT792	Individual Protein	Arachidonate 15-lipoxygenase	Homo sapiens	Potency	=	19952.6	nM	PMID[448599]
NPT197	Protein-Protein Interaction	Menin/Histone-lysine N-methyltransferase MLL	Homo sapiens	Potency	=	25118.9	nM	PMID[448602]
NPT197	Protein-Protein Interaction	Menin/Histone-lysine N-methyltransferase MLL	Homo sapiens	Potency	=	22387.2	nM	PMID[448598]
NPT940	Individual Protein	Serine/threonine-protein kinase mTOR	Homo sapiens	Potency	=	2930.9	nM	PMID[448600]
NPT96	Individual Protein	Thrombopoietin	Homo sapiens	Potency	=	1995.3	nM	PMID[448599]
NPT95	Individual Protein	Muscarinic acetylcholine receptor M1	Rattus norvegicus	Potency	=	35481.3	nM	PMID[448599]
NPT2	Others	Unspecified		Potency	n.a.	12995.3	nM	PMID[448600]
NPT803	Individual Protein	Flap endonuclease 1	Homo sapiens	Potency	n.a.	29934.9	nM	PMID[448600]
NPT7	Individual Protein	Thioredoxin reductase 1, cytoplasmic	Rattus norvegicus	Potency	n.a.	39810.7	nM	PMID[448600]
NPT698	Individual Protein	Regulator of G-protein signaling 4	Homo sapiens	Potency	n.a.	6701.6	nM	PMID[448600]
NPT803	Individual Protein	Flap endonuclease 1	Homo sapiens	Potency	n.a.	15003.0	nM	PMID[448600]
NPT2	Others	Unspecified		Potency	n.a.	7304.8	nM	PMID[448601]
NPT2	Others	Unspecified		Potency	n.a.	7304.8	nM	PMID[448598]
NPT2	Others	Unspecified		Potency	n.a.	7304.8	nM	PMID[448602]
NPT2	Others	Unspecified		Potency	n.a.	7304.8	nM	PMID[448603]
NPT2	Others	Unspecified		Potency	n.a.	7304.8	nM	PMID[448600]
NPT2	Others	Unspecified		Potency	n.a.	7304.8	nM	PMID[448599]
NPT888	Individual Protein	78 kDa glucose-regulated protein	Homo sapiens	Potency	n.a.	20749.1	nM	PMID[448600]
NPT2	Others	Unspecified		Potency	n.a.	33173.4	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	1662.6	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	29824.5	nM	PMID[448605]
NPT20529	NON-MOLECULAR	NON-PROTEIN TARGET	n.a.	Potency	n.a.	23485.0	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	2956.6	nM	PMID[448605]
NPT72	Individual Protein	Solute carrier organic anion transporter family member 1B3	Homo sapiens	Inhibition	=	24.9	%	PMID[448606]
NPT73	Individual Protein	Solute carrier organic anion transporter family member 1B1	Homo sapiens	Inhibition	=	-0.7	%	PMID[448606]
NPT175	Organism	Enterococcus faecalis	Enterococcus faecalis	MIC90	=	32.0	ug.mL-1	PMID[448607]
NPT16	Organism	Staphylococcus aureus	Staphylococcus aureus	MIC90	=	4.0	ug.mL-1	PMID[448607]
NPT3814	Protein Complex	Cyclin-dependent kinase 2/cyclin A	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT2544	Protein Complex	Cyclin-dependent kinase 2/cyclin E	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT982	Individual Protein	Inhibitor of nuclear factor kappa B kinase alpha subunit	Homo sapiens	Residual Activity	=	83.0	%	PMID[448608]
NPT981	Individual Protein	Inhibitor of nuclear factor kappa B kinase beta subunit	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT2544	Protein Complex	Cyclin-dependent kinase 2/cyclin E	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT1609	Protein Complex	Casein kinase II	Homo sapiens	Residual Activity	=	92.0	%	PMID[448608]
NPT981	Individual Protein	Inhibitor of nuclear factor kappa B kinase beta subunit	Homo sapiens	Residual Activity	=	84.0	%	PMID[448608]
NPT4087	Protein Complex	CDK3/cyclin E	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT4087	Protein Complex	CDK3/cyclin E	Homo sapiens	Residual Activity	=	85.0	%	PMID[448608]
NPT1609	Protein Complex	Casein kinase II	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT1509	Protein Complex	Cyclin-dependent kinase 5/CDK5 activator 1	Homo sapiens	Residual Activity	=	106.0	%	PMID[448608]
NPT1509	Protein Complex	Cyclin-dependent kinase 5/CDK5 activator 1	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT1509	Protein Complex	Cyclin-dependent kinase 5/CDK5 activator 1	Homo sapiens	Residual Activity	=	89.0	%	PMID[448608]
NPT1509	Protein Complex	Cyclin-dependent kinase 5/CDK5 activator 1	Homo sapiens	Residual Activity	=	91.0	%	PMID[448608]
NPT4089	Protein Complex	CDK6/cyclin D3	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT4089	Protein Complex	CDK6/cyclin D3	Homo sapiens	Residual Activity	=	82.0	%	PMID[448608]
NPT676	Individual Protein	Glycogen synthase kinase-3 alpha	Homo sapiens	Residual Activity	=	126.0	%	PMID[448608]
NPT833	Individual Protein	Tyrosine-protein kinase BTK	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT4090	Protein Complex	Cyclin-dependent kinase 7/ cyclin H	Homo sapiens	Residual Activity	=	87.0	%	PMID[448608]
NPT4090	Protein Complex	Cyclin-dependent kinase 7/ cyclin H	Homo sapiens	Residual Activity	=	114.0	%	PMID[448608]
NPT676	Individual Protein	Glycogen synthase kinase-3 alpha	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT4091	Protein Complex	AMP-activated protein kinase (AMPK) alpha-1/beta-1/gamma-1	Homo sapiens	Residual Activity	=	96.0	%	PMID[448608]
NPT833	Individual Protein	Tyrosine-protein kinase BTK	Homo sapiens	Residual Activity	=	102.0	%	PMID[448608]
NPT4092	Protein Complex	CDK9/cyclin T1	Homo sapiens	Residual Activity	=	113.0	%	PMID[448608]
NPT4091	Protein Complex	AMP-activated protein kinase (AMPK) alpha-1/beta-1/gamma-1	Homo sapiens	Residual Activity	=	66.0	%	PMID[448608]
NPT4092	Protein Complex	CDK9/cyclin T1	Homo sapiens	Residual Activity	=	93.0	%	PMID[448608]
NPT1767	Protein Complex	AMP-activated protein kinase, AMPK	Homo sapiens	Residual Activity	=	89.0	%	PMID[448608]
NPT1767	Protein Complex	AMP-activated protein kinase, AMPK	Homo sapiens	Residual Activity	=	60.0	%	PMID[448608]
NPT1561	Protein Complex	Cyclin-dependent kinase 1/cyclin B1	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT1561	Protein Complex	Cyclin-dependent kinase 1/cyclin B1	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT3814	Protein Complex	Cyclin-dependent kinase 2/cyclin A	Homo sapiens	Residual Activity	=	137.0	%	PMID[448608]
NPT982	Individual Protein	Inhibitor of nuclear factor kappa B kinase alpha subunit	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT887	Individual Protein	Protein kinase C theta	Homo sapiens	Residual Activity	=	90.0	%	PMID[448608]
NPT728	Individual Protein	Serine/threonine-protein kinase AKT	Homo sapiens	Residual Activity	=	98.0	%	PMID[448608]
NPT887	Individual Protein	Protein kinase C theta	Homo sapiens	Residual Activity	=	66.0	%	PMID[448608]
NPT728	Individual Protein	Serine/threonine-protein kinase AKT	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT831	Individual Protein	Serine/threonine-protein kinase PLK1	Homo sapiens	Residual Activity	=	108.0	%	PMID[448608]
NPT831	Individual Protein	Serine/threonine-protein kinase PLK1	Homo sapiens	Residual Activity	=	75.0	%	PMID[448608]
NPT760	Individual Protein	Protein kinase C beta	Homo sapiens	Residual Activity	=	110.0	%	PMID[448608]
NPT760	Individual Protein	Protein kinase C beta	Homo sapiens	Residual Activity	=	98.0	%	PMID[448608]
NPT760	Individual Protein	Protein kinase C beta	Homo sapiens	Residual Activity	=	87.0	%	PMID[448608]
NPT760	Individual Protein	Protein kinase C beta	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT880	Individual Protein	Protein kinase C gamma	Homo sapiens	Residual Activity	=	97.0	%	PMID[448608]
NPT880	Individual Protein	Protein kinase C gamma	Homo sapiens	Residual Activity	=	101.0	%	PMID[448608]
NPT940	Individual Protein	Serine/threonine-protein kinase mTOR	Homo sapiens	Residual Activity	=	107.0	%	PMID[448608]
NPT881	Individual Protein	Protein kinase C delta	Homo sapiens	Residual Activity	=	104.0	%	PMID[448608]
NPT881	Individual Protein	Protein kinase C delta	Homo sapiens	Residual Activity	=	103.0	%	PMID[448608]
NPT940	Individual Protein	Serine/threonine-protein kinase mTOR	Homo sapiens	Residual Activity	=	88.0	%	PMID[448608]
NPT761	Individual Protein	Protein kinase C epsilon	Homo sapiens	Residual Activity	=	88.0	%	PMID[448608]
NPT940	Individual Protein	Serine/threonine-protein kinase mTOR	Homo sapiens	Residual Activity	=	98.0	%	PMID[448608]
NPT940	Individual Protein	Serine/threonine-protein kinase mTOR	Homo sapiens	Residual Activity	=	89.0	%	PMID[448608]
NPT761	Individual Protein	Protein kinase C epsilon	Homo sapiens	Residual Activity	=	78.0	%	PMID[448608]
NPT175	Organism	Enterococcus faecalis	Enterococcus faecalis	MIC	=	32.0	ug.mL-1	PMID[448609]
NPT16	Organism	Staphylococcus aureus	Staphylococcus aureus	MIC	=	4.0	ug.mL-1	PMID[448609]
NPT175	Organism	Enterococcus faecalis	Enterococcus faecalis	MIC=>90	=	32.0	ug ml-1	PMID[448610]
NPT16	Organism	Staphylococcus aureus	Staphylococcus aureus	MIC=>90	=	4.0	ug ml-1	PMID[448610]
NPT20529	NON-MOLECULAR	NON-PROTEIN TARGET	n.a.	Potency	n.a.	18821.2	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	31622.8	nM	PMID[448611]
NPT20529	NON-MOLECULAR	NON-PROTEIN TARGET	n.a.	Potency	n.a.	16774.4	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	28183.8	nM	PMID[448611]
NPT2	Others	Unspecified		Potency	n.a.	10000.0	nM	PMID[448612]
NPT2	Others	Unspecified		Potency	n.a.	10000.0	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	35481.3	nM	PMID[448611]
NPT20529	NON-MOLECULAR	NON-PROTEIN TARGET	n.a.	Potency	n.a.	10583.9	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	4466.8	nM	PMID[448612]
NPT2	Others	Unspecified		Potency	n.a.	9200.0	nM	PMID[448600]
NPT2	Others	Unspecified		Potency	n.a.	17782.8	nM	PMID[448605]
NPT20529	NON-MOLECULAR	NON-PROTEIN TARGET	n.a.	Potency	n.a.	74.9	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	10000.0	nM	PMID[448611]
NPT2	Others	Unspecified		Potency	n.a.	12589.3	nM	PMID[448600]
NPT2	Others	Unspecified		Potency	n.a.	1000.0	nM	PMID[448600]
NPT2	Others	Unspecified		Potency	n.a.	18654.8	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	39810.7	nM	PMID[448612]
NPT2	Others	Unspecified		Potency	n.a.	833.3	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	6619.0	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	8332.8	nM	PMID[448605]
NPT2	Others	Unspecified		Potency	n.a.	1320.7	nM	PMID[448605]
NPT2	Others	Unspecified		Delta Tm	=	19.6	degrees C	PMID[448614]
NPT2	Others	Unspecified		Delta Tm	=	24.3	degrees C	PMID[448614]
NPT2	Others	Unspecified		Delta Tm	=	0.1	degrees C	PMID[448614]
NPT2	Others	Unspecified		K	=	7.35	10'5/M	PMID[448614]
NPT2	Others	Unspecified		IC50	=	6600.0	nM	PMID[448614]
NPT20529	NON-MOLECULAR	NON-PROTEIN TARGET	n.a.	Inhibition	=	100.0	%	PMID[448614]
NPT20529	NON-MOLECULAR	NON-PROTEIN TARGET	n.a.	IC50	=	12700.0	nM	PMID[448615]
NPT20529	NON-MOLECULAR	NON-PROTEIN TARGET	n.a.	GI	=	92.7	%	PMID[448615]
NPT20529	NON-MOLECULAR	NON-PROTEIN TARGET	n.a.	IC50	=	1490.0	nM	PMID[448615]
NPT20529	NON-MOLECULAR	NON-PROTEIN TARGET	n.a.	GI	=	88.4	%	PMID[448615]
NPT2	Others	Unspecified		Ratio IC50	>	36.4	n.a.	PMID[448616]
NPT21577	NUCLEIC-ACID	quadruplex DNA	Homo sapiens	EC50	=	2590.0	nM	PMID[448617]
NPT21577	NUCLEIC-ACID	quadruplex DNA	Homo sapiens	EC50	=	3750.0	nM	PMID[448617]
NPT2	Others	Unspecified		Ratio EC50	=	0.7	n.a.	PMID[448617]
NPT21579	SINGLE PROTEIN	Sarcoplasmic/endoplasmic reticulum calcium ATPase 1	Homo sapiens	IC50	=	27000.0	nM	PMID[448618]
NPT2	Others	Unspecified		IC50	=	1500.0	nM	PMID[448618]
NPT99	Individual Protein	Peroxisome proliferator-activated receptor gamma	Homo sapiens	IC50	=	566.0	nM	PMID[448619]
NPT2	Others	Unspecified		Ratio IC50	=	0.75	n.a.	PMID[448620]
NPT2	Others	Unspecified		Ratio IC50	=	0.87	n.a.	PMID[448620]
NPT2	Others	Unspecified		Ratio IC50	=	0.48	n.a.	PMID[448620]
NPT2	Others	Unspecified		Ratio IC50	=	0.96	n.a.	PMID[448620]
NPT2	Others	Unspecified		Ratio IC50	=	0.99	n.a.	PMID[448620]
NPT2	Others	Unspecified		Ratio IC50	=	1.15	n.a.	PMID[448620]
NPT2	Others	Unspecified		Ratio IC50	=	0.64	n.a.	PMID[448620]
NPT2	Others	Unspecified		IC50	=	3730.0	nM	PMID[448620]
NPT2	Others	Unspecified		Ratio IC50	=	0.73	n.a.	PMID[448620]
NPT2	Others	Unspecified		Selectivity Index	=	5.92	n.a.	PMID[448622]

☑ Note for Activity Records:
☉ The quantitative biological activities were primarily integrated from ChEMBL (Version-30) database and were also directly collected from PubMed literature. PubMed PMID was provided as the reference link for each activity record.

Chemically structural similarity: I. Similar Active Natural Products in NPASS

Top-200 similar NPs were calculated against the active-NP-set (includes 4,3285 NPs with experimentally-derived bioactivity available in NPASS)

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient

● The left chart: Distribution of similarity level between NPC100079 and all remaining natural products in the NPASS database.
● The right table: Most similar natural products (Tc>=0.56 or Top200).

range	Tanimoto Coefficient
0-0.1	693
0.1-0.2	3769
0.2-0.3	12981
0.3-0.4	5397
0.4-0.5	13599
0.5-0.6	4112
0.6-0.7	1765
0.7-0.8	321
0.8-0.85	29
0.85-0.9	13
0.9-0.95	10
0.95-1	8

Similarity Score	Similarity Level	Natural Product ID
1.0	High Similarity	NPC23614
0.9846	High Similarity	NPC46451
0.9845	High Similarity	NPC235076
0.9793	High Similarity	NPC271215
0.9793	High Similarity	NPC149471
0.9637	High Similarity	NPC188420
0.95	High Similarity	NPC118121
0.93	High Similarity	NPC204446
0.9242	High Similarity	NPC202768
0.9242	High Similarity	NPC53069
0.9242	High Similarity	NPC296482
0.9146	High Similarity	NPC251160
0.905	High Similarity	NPC96405
0.905	High Similarity	NPC171409
0.9026	High Similarity	NPC31930
0.899	High Similarity	NPC313189
0.8889	High Similarity	NPC36229
0.8889	High Similarity	NPC16452
0.8889	High Similarity	NPC476581
0.8878	High Similarity	NPC234197
0.8878	High Similarity	NPC477019
0.88	High Similarity	NPC135549
0.8636	High Similarity	NPC4071
0.8636	High Similarity	NPC476582
0.8636	High Similarity	NPC476578
0.8585	High Similarity	NPC112206
0.8585	High Similarity	NPC202605
0.852	High Similarity	NPC195268
0.852	High Similarity	NPC133140
0.8446	Intermediate Similarity	NPC179704
0.8387	Intermediate Similarity	NPC22481
0.8333	Intermediate Similarity	NPC278525
0.8311	Intermediate Similarity	NPC108342
0.8309	Intermediate Similarity	NPC290689
0.829	Intermediate Similarity	NPC287588
0.8273	Intermediate Similarity	NPC182907
0.8273	Intermediate Similarity	NPC189903
0.8265	Intermediate Similarity	NPC204385
0.8235	Intermediate Similarity	NPC166722
0.8224	Intermediate Similarity	NPC122463
0.8131	Intermediate Similarity	NPC174049
0.8122	Intermediate Similarity	NPC249405
0.8109	Intermediate Similarity	NPC302001
0.81	Intermediate Similarity	NPC253675
0.8095	Intermediate Similarity	NPC208284
0.808	Intermediate Similarity	NPC210296
0.8061	Intermediate Similarity	NPC206201
0.8056	Intermediate Similarity	NPC210434
0.8053	Intermediate Similarity	NPC124313
0.805	Intermediate Similarity	NPC474904
0.805	Intermediate Similarity	NPC312531
0.8044	Intermediate Similarity	NPC84164
0.8044	Intermediate Similarity	NPC207283
0.8	Intermediate Similarity	NPC24019
0.7951	Intermediate Similarity	NPC193906
0.7951	Intermediate Similarity	NPC23080
0.7948	Intermediate Similarity	NPC270515
0.7941	Intermediate Similarity	NPC162653
0.7907	Intermediate Similarity	NPC473513
0.7892	Intermediate Similarity	NPC255800
0.7892	Intermediate Similarity	NPC96584
0.7883	Intermediate Similarity	NPC201508
0.7879	Intermediate Similarity	NPC183537
0.7877	Intermediate Similarity	NPC470020
0.787	Intermediate Similarity	NPC473822
0.7857	Intermediate Similarity	NPC304183
0.785	Intermediate Similarity	NPC162530
0.7826	Intermediate Similarity	NPC212163
0.7817	Intermediate Similarity	NPC285941
0.781	Intermediate Similarity	NPC285558
0.7806	Intermediate Similarity	NPC312872
0.7802	Intermediate Similarity	NPC77878
0.7794	Intermediate Similarity	NPC141915
0.7794	Intermediate Similarity	NPC114335
0.7794	Intermediate Similarity	NPC280964
0.7788	Intermediate Similarity	NPC173080
0.7783	Intermediate Similarity	NPC214980
0.7778	Intermediate Similarity	NPC90875
0.7768	Intermediate Similarity	NPC233334
0.7767	Intermediate Similarity	NPC266931
0.7767	Intermediate Similarity	NPC236668
0.7763	Intermediate Similarity	NPC217554
0.7752	Intermediate Similarity	NPC148409
0.7751	Intermediate Similarity	NPC295676
0.7743	Intermediate Similarity	NPC295228
0.7739	Intermediate Similarity	NPC284141
0.7731	Intermediate Similarity	NPC146976
0.7723	Intermediate Similarity	NPC476999
0.7713	Intermediate Similarity	NPC476997
0.771	Intermediate Similarity	NPC11464
0.7703	Intermediate Similarity	NPC11017
0.77	Intermediate Similarity	NPC190461
0.7679	Intermediate Similarity	NPC476998
0.7679	Intermediate Similarity	NPC476996
0.7675	Intermediate Similarity	NPC11408
0.7656	Intermediate Similarity	NPC287437
0.7642	Intermediate Similarity	NPC156728
0.7642	Intermediate Similarity	NPC244606
0.7634	Intermediate Similarity	NPC476994
0.7625	Intermediate Similarity	NPC132385
0.7623	Intermediate Similarity	NPC200888
0.7617	Intermediate Similarity	NPC470931
0.7615	Intermediate Similarity	NPC170114
0.759	Intermediate Similarity	NPC24954
0.7577	Intermediate Similarity	NPC470889
0.7569	Intermediate Similarity	NPC470549
0.756	Intermediate Similarity	NPC224928
0.7558	Intermediate Similarity	NPC316981
0.7555	Intermediate Similarity	NPC473183
0.7549	Intermediate Similarity	NPC33902
0.7549	Intermediate Similarity	NPC276674
0.7546	Intermediate Similarity	NPC167860
0.7546	Intermediate Similarity	NPC123976
0.7545	Intermediate Similarity	NPC470018
0.7543	Intermediate Similarity	NPC15406
0.7538	Intermediate Similarity	NPC477559
0.7538	Intermediate Similarity	NPC232924
0.7538	Intermediate Similarity	NPC160298
0.7538	Intermediate Similarity	NPC306902
0.7538	Intermediate Similarity	NPC266753
0.7523	Intermediate Similarity	NPC323345
0.7523	Intermediate Similarity	NPC470164
0.7512	Intermediate Similarity	NPC475774
0.7511	Intermediate Similarity	NPC74575
0.75	Intermediate Similarity	NPC174758
0.75	Intermediate Similarity	NPC174672
0.75	Intermediate Similarity	NPC201697
0.7489	Intermediate Similarity	NPC280272
0.7488	Intermediate Similarity	NPC193777
0.7478	Intermediate Similarity	NPC476995
0.7477	Intermediate Similarity	NPC137929
0.7477	Intermediate Similarity	NPC164374
0.7476	Intermediate Similarity	NPC320088
0.7475	Intermediate Similarity	NPC476432
0.7475	Intermediate Similarity	NPC24264
0.7467	Intermediate Similarity	NPC473184
0.7456	Intermediate Similarity	NPC49547
0.7455	Intermediate Similarity	NPC322482
0.7454	Intermediate Similarity	NPC82548
0.7437	Intermediate Similarity	NPC247389
0.7432	Intermediate Similarity	NPC213530
0.7432	Intermediate Similarity	NPC193267
0.7424	Intermediate Similarity	NPC473182
0.7424	Intermediate Similarity	NPC167546
0.7424	Intermediate Similarity	NPC16805
0.7424	Intermediate Similarity	NPC225774
0.7424	Intermediate Similarity	NPC302527
0.7418	Intermediate Similarity	NPC232727
0.7418	Intermediate Similarity	NPC267423
0.7407	Intermediate Similarity	NPC474595
0.7404	Intermediate Similarity	NPC92111
0.7399	Intermediate Similarity	NPC477533
0.7389	Intermediate Similarity	NPC202503
0.7387	Intermediate Similarity	NPC219341
0.7382	Intermediate Similarity	NPC99891
0.7381	Intermediate Similarity	NPC131017
0.7371	Intermediate Similarity	NPC315957
0.7371	Intermediate Similarity	NPC176538
0.7364	Intermediate Similarity	NPC474594
0.7364	Intermediate Similarity	NPC478074
0.7359	Intermediate Similarity	NPC470017
0.7358	Intermediate Similarity	NPC17677
0.7357	Intermediate Similarity	NPC473185
0.7356	Intermediate Similarity	NPC76748
0.7356	Intermediate Similarity	NPC296742
0.735	Intermediate Similarity	NPC210918
0.735	Intermediate Similarity	NPC298979
0.7349	Intermediate Similarity	NPC162484
0.7346	Intermediate Similarity	NPC194967
0.7333	Intermediate Similarity	NPC78284
0.7333	Intermediate Similarity	NPC307963
0.7328	Intermediate Similarity	NPC470022
0.7318	Intermediate Similarity	NPC473180
0.7318	Intermediate Similarity	NPC48353
0.7318	Intermediate Similarity	NPC94157
0.7318	Intermediate Similarity	NPC26679
0.7313	Intermediate Similarity	NPC227908
0.7313	Intermediate Similarity	NPC241055
0.7308	Intermediate Similarity	NPC224293
0.7308	Intermediate Similarity	NPC296527
0.7302	Intermediate Similarity	NPC199277
0.7302	Intermediate Similarity	NPC135887
0.73	Intermediate Similarity	NPC86144
0.73	Intermediate Similarity	NPC304659
0.7297	Intermediate Similarity	NPC274982
0.7293	Intermediate Similarity	NPC469792
0.729	Intermediate Similarity	NPC329747
0.7288	Intermediate Similarity	NPC208522
0.7281	Intermediate Similarity	NPC472111
0.7277	Intermediate Similarity	NPC17565
0.7277	Intermediate Similarity	NPC72211
0.7273	Intermediate Similarity	NPC112676
0.7264	Intermediate Similarity	NPC251090
0.7264	Intermediate Similarity	NPC13880
0.7264	Intermediate Similarity	NPC473053
0.7261	Intermediate Similarity	NPC475253
0.726	Intermediate Similarity	NPC469589
0.726	Intermediate Similarity	NPC185782
0.726	Intermediate Similarity	NPC69213
0.725	Intermediate Similarity	NPC168409

Chemically structural similarity: II. Similar Clinical/Approved Drugs

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

● The left chart: Distribution of similarity level between NPC100079 and all drugs/candidates.
● The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

range	Tanimoto Coefficient
0-0.1	383
0.1-0.2	673
0.2-0.3	919
0.3-0.4	1604
0.4-0.5	2753
0.5-0.6	2035
0.6-0.7	694
0.7-0.8	84
0.8-0.85	1
0.85-0.9	1
0.9-0.95	2
0.95-1	1

Similarity Score	Similarity Level	Drug ID	Developmental Stage
0.9846	High Similarity	NPD3763	Approved
0.9242	High Similarity	NPD3816	Phase 1
0.9242	High Similarity	NPD3815	Phase 1
0.852	High Similarity	NPD3924	Approved
0.852	High Similarity	NPD3923	Approved
0.852	High Similarity	NPD3921	Approved
0.852	High Similarity	NPD3922	Approved
0.8054	Intermediate Similarity	NPD6494	Phase 2
0.7959	Intermediate Similarity	NPD3920	Phase 2
0.7867	Intermediate Similarity	NPD5658	Approved
0.7817	Intermediate Similarity	NPD6230	Discontinued
0.7721	Intermediate Similarity	NPD7069	Discontinued
0.7689	Intermediate Similarity	NPD5530	Phase 1
0.7685	Intermediate Similarity	NPD6257	Clinical (unspecified phase)
0.7679	Intermediate Similarity	NPD7567	Approved
0.766	Intermediate Similarity	NPD4926	Clinical (unspecified phase)
0.7653	Intermediate Similarity	NPD7222	Phase 2
0.7633	Intermediate Similarity	NPD4418	Discontinued
0.7612	Intermediate Similarity	NPD7414	Clinical (unspecified phase)
0.761	Intermediate Similarity	NPD6281	Approved
0.7559	Intermediate Similarity	NPD4795	Phase 2
0.7556	Intermediate Similarity	NPD7555	Discontinued
0.7547	Intermediate Similarity	NPD6975	Discontinued
0.7544	Intermediate Similarity	NPD6963	Approved
0.7544	Intermediate Similarity	NPD6964	Approved
0.7533	Intermediate Similarity	NPD4885	Approved
0.75	Intermediate Similarity	NPD7558	Phase 2
0.7477	Intermediate Similarity	NPD5070	Clinical (unspecified phase)
0.7443	Intermediate Similarity	NPD7571	Clinical (unspecified phase)
0.7415	Intermediate Similarity	NPD4889	Approved
0.7409	Intermediate Similarity	NPD5903	Approved
0.7409	Intermediate Similarity	NPD5902	Approved
0.7407	Intermediate Similarity	NPD7453	Approved
0.7407	Intermediate Similarity	NPD7452	Approved
0.7399	Intermediate Similarity	NPD5930	Phase 3
0.7389	Intermediate Similarity	NPD7676	Clinical (unspecified phase)
0.7389	Intermediate Similarity	NPD7675	Phase 3
0.7389	Intermediate Similarity	NPD7674	Phase 3
0.7383	Intermediate Similarity	NPD6477	Clinical (unspecified phase)
0.7371	Intermediate Similarity	NPD1739	Approved
0.7371	Intermediate Similarity	NPD7729	Clinical (unspecified phase)
0.7371	Intermediate Similarity	NPD1740	Approved
0.7368	Intermediate Similarity	NPD6569	Phase 2
0.7345	Intermediate Similarity	NPD7719	Discontinued
0.7344	Intermediate Similarity	NPD8091	Phase 3
0.7333	Intermediate Similarity	NPD1304	Clinical (unspecified phase)
0.7333	Intermediate Similarity	NPD1038	Approved
0.7297	Intermediate Similarity	NPD5612	Discontinued
0.7294	Intermediate Similarity	NPD5863	Clinical (unspecified phase)
0.729	Intermediate Similarity	NPD6219	Discontinued
0.7277	Intermediate Similarity	NPD1923	Clinical (unspecified phase)
0.7273	Intermediate Similarity	NPD7169	Suspended
0.7264	Intermediate Similarity	NPD1078	Clinical (unspecified phase)
0.7252	Intermediate Similarity	NPD6140	Clinical (unspecified phase)
0.7249	Intermediate Similarity	NPD7710	Clinical (unspecified phase)
0.7248	Intermediate Similarity	NPD5429	Discontinued
0.7246	Intermediate Similarity	NPD7424	Clinical (unspecified phase)
0.7243	Intermediate Similarity	NPD4118	Clinical (unspecified phase)
0.7237	Intermediate Similarity	NPD7426	Phase 1
0.7235	Intermediate Similarity	NPD4035	Approved
0.7235	Intermediate Similarity	NPD32	Approved
0.7235	Intermediate Similarity	NPD4122	Approved
0.7235	Intermediate Similarity	NPD4033	Approved
0.7235	Intermediate Similarity	NPD31	Approved
0.7235	Intermediate Similarity	NPD4034	Approved
0.7235	Intermediate Similarity	NPD4038	Approved
0.7235	Intermediate Similarity	NPD4036	Approved
0.7235	Intermediate Similarity	NPD4039	Approved
0.7235	Intermediate Similarity	NPD4037	Approved
0.7234	Intermediate Similarity	NPD6790	Phase 1
0.7217	Intermediate Similarity	NPD6861	Clinical (unspecified phase)
0.7217	Intermediate Similarity	NPD5801	Clinical (unspecified phase)
0.7203	Intermediate Similarity	NPD4876	Phase 3
0.7203	Intermediate Similarity	NPD4875	Phase 3
0.7191	Intermediate Similarity	NPD8016	Phase 3
0.7191	Intermediate Similarity	NPD8017	Clinical (unspecified phase)
0.7185	Intermediate Similarity	NPD5488	Discontinued
0.7183	Intermediate Similarity	NPD3478	Clinical (unspecified phase)
0.7183	Intermediate Similarity	NPD3477	Phase 2
0.7178	Intermediate Similarity	NPD7859	Phase 2
0.7168	Intermediate Similarity	NPD7678	Clinical (unspecified phase)
0.7156	Intermediate Similarity	NPD3397	Phase 2
0.7137	Intermediate Similarity	NPD6503	Clinical (unspecified phase)
0.7136	Intermediate Similarity	NPD7672	Approved
0.7136	Intermediate Similarity	NPD7671	Approved
0.7131	Intermediate Similarity	NPD6517	Phase 3
0.7123	Intermediate Similarity	NPD2060	Approved
0.7117	Intermediate Similarity	NPD4502	Phase 2
0.7113	Intermediate Similarity	NPD8100	Phase 3
0.7112	Intermediate Similarity	NPD4995	Approved
0.7112	Intermediate Similarity	NPD4996	Approved
0.7111	Intermediate Similarity	NPD7823	Clinical (unspecified phase)
0.7101	Intermediate Similarity	NPD3386	Phase 2
0.7091	Intermediate Similarity	NPD1392	Approved
0.7089	Intermediate Similarity	NPD7417	Discontinued
0.7089	Intermediate Similarity	NPD4551	Phase 2
0.7083	Intermediate Similarity	NPD3825	Phase 3
0.7081	Intermediate Similarity	NPD6344	Clinical (unspecified phase)
0.708	Intermediate Similarity	NPD3354	Phase 2
0.708	Intermediate Similarity	NPD7395	Discontinued
0.708	Intermediate Similarity	NPD6568	Discontinued
0.7079	Intermediate Similarity	NPD6872	Clinical (unspecified phase)
0.7075	Intermediate Similarity	NPD2334	Discontinued
0.7073	Intermediate Similarity	NPD6375	Clinical (unspecified phase)
0.7069	Intermediate Similarity	NPD4925	Approved
0.7069	Intermediate Similarity	NPD8052	Clinical (unspecified phase)
0.7059	Intermediate Similarity	NPD4859	Phase 1
0.7059	Intermediate Similarity	NPD2739	Clinical (unspecified phase)
0.7056	Intermediate Similarity	NPD6491	Clinical (unspecified phase)
0.7054	Intermediate Similarity	NPD5945	Phase 1
0.7054	Intermediate Similarity	NPD5944	Phase 1
0.7051	Intermediate Similarity	NPD6741	Clinical (unspecified phase)
0.7051	Intermediate Similarity	NPD4396	Clinical (unspecified phase)
0.7048	Intermediate Similarity	NPD7194	Discontinued
0.7045	Intermediate Similarity	NPD3003	Approved
0.704	Intermediate Similarity	NPD5066	Phase 2
0.704	Intermediate Similarity	NPD5067	Phase 2
0.7039	Intermediate Similarity	NPD5751	Clinical (unspecified phase)
0.7035	Intermediate Similarity	NPD5164	Discontinued
0.7033	Intermediate Similarity	NPD7955	Approved
0.7033	Intermediate Similarity	NPD7956	Approved
0.7031	Intermediate Similarity	NPD1954	Phase 1
0.7027	Intermediate Similarity	NPD4437	Phase 3
0.7025	Intermediate Similarity	NPD8101	Phase 3
0.7018	Intermediate Similarity	NPD6242	Discontinued
0.7004	Intermediate Similarity	NPD8109	Clinical (unspecified phase)
0.6991	Remote Similarity	NPD7948	Phase 1
0.6987	Remote Similarity	NPD4881	Clinical (unspecified phase)
0.6987	Remote Similarity	NPD6716	Phase 1
0.6986	Remote Similarity	NPD5522	Clinical (unspecified phase)
0.6983	Remote Similarity	NPD6553	Clinical (unspecified phase)
0.698	Remote Similarity	NPD2780	Approved
0.698	Remote Similarity	NPD2782	Approved
0.6979	Remote Similarity	NPD5040	Clinical (unspecified phase)
0.6976	Remote Similarity	NPD7862	Clinical (unspecified phase)
0.6975	Remote Similarity	NPD5905	Phase 1
0.6968	Remote Similarity	NPD6150	Discontinued
0.6968	Remote Similarity	NPD5601	Phase 2
0.6967	Remote Similarity	NPD4375	Approved
0.6963	Remote Similarity	NPD4372	Phase 1
0.6959	Remote Similarity	NPD7889	Clinical (unspecified phase)
0.6957	Remote Similarity	NPD1856	Discontinued
0.6955	Remote Similarity	NPD6525	Clinical (unspecified phase)
0.6955	Remote Similarity	NPD6991	Approved
0.6955	Remote Similarity	NPD6244	Phase 3
0.6955	Remote Similarity	NPD6243	Phase 3
0.6951	Remote Similarity	NPD2125	Clinical (unspecified phase)
0.6942	Remote Similarity	NPD8358	Approved
0.6942	Remote Similarity	NPD5602	Clinical (unspecified phase)
0.694	Remote Similarity	NPD7051	Phase 3
0.694	Remote Similarity	NPD7050	Clinical (unspecified phase)
0.6938	Remote Similarity	NPD4203	Approved
0.6938	Remote Similarity	NPD4204	Approved
0.6935	Remote Similarity	NPD6228	Discontinued
0.693	Remote Similarity	NPD802	Phase 2
0.693	Remote Similarity	NPD5575	Clinical (unspecified phase)
0.6927	Remote Similarity	NPD3837	Clinical (unspecified phase)
0.6923	Remote Similarity	NPD6968	Phase 2
0.6923	Remote Similarity	NPD6969	Phase 2
0.6913	Remote Similarity	NPD6298	Discontinued
0.6912	Remote Similarity	NPD6769	Clinical (unspecified phase)
0.6912	Remote Similarity	NPD2781	Approved
0.691	Remote Similarity	NPD7268	Clinical (unspecified phase)
0.6906	Remote Similarity	NPD2189	Approved
0.6906	Remote Similarity	NPD5529	Phase 1
0.6906	Remote Similarity	NPD2187	Approved
0.6906	Remote Similarity	NPD5528	Clinical (unspecified phase)
0.6904	Remote Similarity	NPD7025	Clinical (unspecified phase)
0.6892	Remote Similarity	NPD7803	Approved
0.6889	Remote Similarity	NPD5936	Approved
0.6889	Remote Similarity	NPD5939	Approved
0.6889	Remote Similarity	NPD4131	Phase 3
0.6888	Remote Similarity	NPD4584	Approved
0.6887	Remote Similarity	NPD4921	Phase 3
0.6887	Remote Similarity	NPD4919	Phase 3
0.6887	Remote Similarity	NPD4920	Clinical (unspecified phase)
0.6883	Remote Similarity	NPD8244	Phase 2
0.688	Remote Similarity	NPD5559	Phase 2
0.6878	Remote Similarity	NPD4724	Clinical (unspecified phase)
0.6872	Remote Similarity	NPD5083	Clinical (unspecified phase)
0.6867	Remote Similarity	NPD7708	Approved
0.6866	Remote Similarity	NPD6550	Discontinued
0.6865	Remote Similarity	NPD6773	Clinical (unspecified phase)
0.686	Remote Similarity	NPD5483	Clinical (unspecified phase)
0.6856	Remote Similarity	NPD6985	Discontinued
0.6852	Remote Similarity	NPD6361	Phase 2
0.6851	Remote Similarity	NPD1900	Clinical (unspecified phase)
0.6849	Remote Similarity	NPD6661	Clinical (unspecified phase)
0.6849	Remote Similarity	NPD5891	Approved
0.6849	Remote Similarity	NPD4548	Discontinued
0.6846	Remote Similarity	NPD6473	Phase 1
0.6845	Remote Similarity	NPD5934	Clinical (unspecified phase)
0.6842	Remote Similarity	NPD1620	Clinical (unspecified phase)
0.6842	Remote Similarity	NPD6147	Clinical (unspecified phase)
0.6842	Remote Similarity	NPD8442	Discontinued
0.6842	Remote Similarity	NPD7112	Discontinued
0.684	Remote Similarity	NPD5506	Approved
0.684	Remote Similarity	NPD5507	Approved
0.6835	Remote Similarity	NPD2952	Discontinued
0.6833	Remote Similarity	NPD6208	Discontinued

Bioactivity similarity: Similar Natural Products in NPASS

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