NPASS Compound

Natural Product: NPC487966

Natural Product ID	NPC487966
Common Name ? The InCHIKey will be temporarily assigned as the "Common Name" if no IUPAC name or alternative short name is available.	OHKOGUYZJXTSFX-KZFFXBSXSA-N
IUPAC Name	n.a.
Synonyms
Synthetic Gene Cluster	n.a.
ChEMBL Identifier	n.a.
PubChem CID	36921
Chemical Classification	CHEMONTID:0000000 [Organic compounds] [CHEMONTID:0000264] Organic acids and derivatives [CHEMONTID:0000265] Carboxylic acids and derivatives [CHEMONTID:0000013] Amino acids, peptides, and analogues [CHEMONTID:0000348] Peptides [CHEMONTID:0004830] Dipeptides

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

Chemical Representations

RDKit 3D 41 43 0 0 0 0 0 0 0 0999 V2000 2.5019 -0.0440 2.3888 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8540 0.1153 0.9439 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9724 1.0785 0.7084 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1298 -1.2098 0.2724 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1338 -1.1536 -0.7904 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2882 -0.7394 -0.5093 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9149 -1.5267 -2.1103 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9038 -1.7159 -0.2397 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7916 -2.5523 -0.5068 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4758 -3.7783 -0.3688 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -1.4448 -1.0784 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2898 -0.7415 -1.1372 C 0 0 1 0 0 0 0 0 0 0 0 0 1.4205 0.7237 -0.0347 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -0.8999 -0.2131 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5305 0.2521 -0.4346 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5733 0.7857 0.5085 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.8526 1.0271 -0.2894 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4896 0.0667 -0.9216 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6584 0.3565 -1.6357 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8260 2.1155 -1.3650 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3820 2.3519 -0.3536 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8620 -0.2041 1.5729 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2345 -1.2900 1.6055 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8182 0.0544 2.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1086 0.9737 -1.5318 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4352 -0.1270 2.6005 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9155 0.8189 2.9561 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0275 -0.9640 2.7775 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0612 1.2419 -0.3945 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6947 2.0876 1.1131 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9203 0.8167 1.1901 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5227 -1.8811 1.0671 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4388 -1.0179 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4339 -1.6420 -2.0829 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7602 -0.6212 -2.1094 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2238 1.7232 0.9439 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1503 -1.0228 -0.9327 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3047 -0.2905 -2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0157 3.2267 0.0799 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1942 -0.6464 3.1533 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7389 0.5218 -2.3571 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 4 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 11 14 1 0 14 15 2 3 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 1 0 16 22 1 0 22 23 2 0 22 24 1 0 15 25 1 0 13 2 1 0 21 17 2 0 12 8 1 0 1 26 1 0 1 27 1 0 1 28 1 0 3 29 1 0 3 30 1 0 3 31 1 0 4 32 1 1 7 33 1 0 11 34 1 6 12 35 1 6 16 36 1 1 18 37 1 0 19 38 1 0 21 39 1 0 24 40 1 0 25 41 1 0 M END

Standard InCHIKey	OHKOGUYZJXTSFX-KZFFXBSXSA-N
Standard InCHI	InChI=1S/C15H16N2O6S2/c1-15(2)9(14(22)23)17-11(19)8(12(17)25-15)16-10(18)7(13(20)21)6-3-4-24-5-6/h3-5,7-9,12H,1-2H3,(H,16,18)(H,20,21)(H,22,23)/t7-,8-,9+,12-/m1/s1
SMILES	CC1(C)[C@H](C(=O)O)N2C(=O)[C@H]([C@H]2S1)N=C([C@@H](c1ccsc1)C(=O)O)O

Calculated Properties

Physi-Chem Properties

MedChem Properties

ADMET Properties (ADMETlab3.0)

ADMET: Absorption

ADMET: Distribution

ADMET: Metabolism

ADMET: Excretion

ADMET: Toxicity

Species Source

Organism ID	Organism Name	Taxonomy Level	Family	SuperKingdom	Isolation Part	Collection Location	Collection Time	Reference
NPO40573	Chryseobacterium indologenes 597	Strain	n.a.	Bacteria	n.a.	n.a.	n.a.	PMID[19651915]

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

NP Quantity Composition/Concentration

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

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

Biological Activity

Activity Type	# Activity
Ratio	7
Ki	4
Activity	21
IC50	1
AC50	34
MIC	645
MIC50	8
MIC90	8
FC	2

Activity Type	# Activity
Individual protein	42
Organism	639
Non-molecular	41
Others	8

Molecular-level activity

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference
NPT261	Individual protein	Monoamine oxidase A	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT246	Individual protein	Dopamine transporter	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT291	Individual protein	Serotonin 2b (5-HT2b) receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT2761	Individual protein	Phosphodiesterase 4A	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT204	Individual protein	Acetylcholinesterase	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT228	Individual protein	Norepinephrine transporter	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT242	Individual protein	Dopamine D1 receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT1788	Individual protein	Alpha-1a adrenergic receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT216	Individual protein	Adenosine A1 receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT2769	Individual protein	Thromboxane A2 receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT145	Individual protein	Mu opioid receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT222	Individual protein	Alpha-2a adrenergic receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT153	Individual protein	Androgen Receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT295	Individual protein	Serotonin transporter	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT108	Individual protein	Estrogen receptor alpha	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT262	Individual protein	Muscarinic acetylcholine receptor M1	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT30	Individual protein	Cyclooxygenase-1	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT263	Individual protein	Muscarinic acetylcholine receptor M2	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT218	Individual protein	Adenosine A3 receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT30	Individual protein	Cyclooxygenase-1	Homo sapiens	AC50	=	15608.8	nM	PMID[37468498]
NPT1478	Individual protein	Vascular endothelial growth factor receptor 2	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT1410	Individual protein	GABA receptor alpha-1 subunit	Rattus norvegicus	AC50	>	30000.0	nM	PMID[37468498]
NPT244	Individual protein	Dopamine D3 receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT5575	Individual protein	Gil1	Citrobacter gillenii	Ratio	=	180.0	n.a.	PMID[17242148]
NPT713	Individual protein	Bile salt export pump	Homo sapiens	AC50	>	300000.0	nM	PMID[37468498]
NPT987	Individual protein	Histamine H3 receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT542	Individual protein	Progesterone receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT98	Individual protein	HERG	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT92	Individual protein	Serotonin 1a (5-HT1a) receptor	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT5104	Individual protein	Phosphodiesterase 3A	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]
NPT661	Individual protein	Solute carrier family 22 member 6	Mus musculus	Ki	=	524807.46	nM	PMID[17553798]
NPT661	Individual protein	Solute carrier family 22 member 6	Mus musculus	Ki	=	530000.0	nM	PMID[17553798]
NPT662	Individual protein	Solute carrier family 22 member 20	Mus musculus	Ki	=	537031.8	nM	PMID[17553798]
NPT662	Individual protein	Solute carrier family 22 member 20	Mus musculus	Ki	=	533000.0	nM	PMID[17553798]
NPT5577	Individual protein	Beta-lactamase	Bacillus clausii	Activity	=	12.0	n.a.	PMID[17846134]
NPT6537	Individual protein	Metallo-beta-lactamase	Pseudomonas stutzeri	Ratio	=	15000.0	n.a.	PMID[20308383]
NPT877	Individual protein	Solute carrier family 22 member 8	Mus musculus	IC50	=	233000.0	nM	PMID[23344796]
NPT670	Individual protein	Thrombin	Homo sapiens	AC50	>	30000.0	nM	PMID[37468498]

In vitro activity

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference
NPT1033	Organism	Enterobacter cloacae	Enterobacter cloacae	MIC	>	512.0	ug.mL-1	PMID[17116662]
NPT1264	Organism	Burkholderia cepacia	Burkholderia cepacia	Activity	=	2.0	%	PMID[17158942]
NPT566	Organism	Salmonella typhimurium	Salmonella enterica subsp. enterica serovar Typhimurium	MIC	=	4.0	ug.mL-1	PMID[17438056]
NPT1207	Organism	Acinetobacter	Acinetobacter	MIC	>	256.0	ug.mL-1	PMID[17876007]
NPT172	Organism	Proteus mirabilis	Proteus mirabilis	MIC	=	32.0	ug.mL-1	PMID[18025117]
NPT2895	Organism	Providencia stuartii	Providencia stuartii	MIC	>	2048.0	ug.mL-1	PMID[19901092]
NPT1033	Organism	Enterobacter cloacae	Enterobacter cloacae	MIC	>	512.0	ug.mL-1	PMID[20086157]
NPT2897	Organism	Citrobacter freundii	Citrobacter freundii	MIC	>	512.0	ug.mL-1	PMID[20086157]
NPT1033	Organism	Enterobacter cloacae	Enterobacter cloacae	MIC	>	256.0	ug.mL-1	PMID[18625772]
NPT5745	Organism	Aeromonas sp.	Aeromonas sp.	MIC	>	256.0	ug.mL-1	PMID[18644966]
NPT5745	Organism	Aeromonas sp.	Aeromonas sp.	MIC	=	128.0	ug.mL-1	PMID[18644966]
NPT2897	Organism	Citrobacter freundii	Citrobacter freundii	MIC	>	512.0	ug.mL-1	PMID[18765691]
NPT2910	Organism	Campylobacter jejuni	Campylobacter jejuni	MIC	=	128.0	ug.mL-1	PMID[19506058]
NPT2910	Organism	Campylobacter jejuni	Campylobacter jejuni	MIC	=	32.0	ug.mL-1	PMID[19506058]
NPT2910	Organism	Campylobacter jejuni	Campylobacter jejuni	MIC	=	8.0	ug.mL-1	PMID[19506058]
NPT2910	Organism	Campylobacter jejuni	Campylobacter jejuni	MIC	=	64.0	ug.mL-1	PMID[19506058]
NPT2910	Organism	Campylobacter jejuni	Campylobacter jejuni	MIC50	=	64.0	ug.mL-1	PMID[19506058]
NPT2910	Organism	Campylobacter jejuni	Campylobacter jejuni	MIC90	=	128.0	ug.mL-1	PMID[19506058]
NPT2910	Organism	Campylobacter jejuni	Campylobacter jejuni	MIC	=	4.0	ug.mL-1	PMID[19506058]
NPT2910	Organism	Campylobacter jejuni	Campylobacter jejuni	MIC	=	2.0	ug.mL-1	PMID[19506058]
NPT2910	Organism	Campylobacter jejuni	Campylobacter jejuni	MIC	<	4.0	ug.mL-1	PMID[19506058]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	64.0	ug.mL-1	PMID[17242148]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	>	512.0	ug.mL-1	PMID[17420213]
NPT14707	Organism	Bacillus clausii	Bacillus clausii	MIC	=	8000.0	ug.mL-1	PMID[17846134]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	>	512000.0	ug.mL-1	PMID[17846134]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	8000.0	ug.mL-1	PMID[17846134]
NPT2911	Organism	Pseudomonas putida	Pseudomonas putida	MIC	>	128.0	ug.mL-1	PMID[17470660]
NPT3496	Organism	Enterobacter	Enterobacter	MIC	>	256.0	ug.mL-1	PMID[17470647]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	MIC	=	16.0	ug.mL-1	PMID[17682106]
NPT4801	Organism	Dialister micraerophilus	Dialister micraerophilus	MIC50	<=	0.06	ug.mL-1	PMID[17923492]
NPT4801	Organism	Dialister micraerophilus	Dialister micraerophilus	MIC	<=	0.06	ug.mL-1	PMID[17923492]
NPT4801	Organism	Dialister micraerophilus	Dialister micraerophilus	MIC90	=	0.5	ug.mL-1	PMID[17923492]
NPT4801	Organism	Dialister micraerophilus	Dialister micraerophilus	Activity	<=	32.0	ug ml-1	PMID[17923492]
NPT4801	Organism	Dialister micraerophilus	Dialister micraerophilus	Activity	<=	16.0	ug ml-1	PMID[17923492]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	MIC	>	256.0	ug.mL-1	PMID[17938181]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	MIC	=	12.0	ug.mL-1	PMID[17938181]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	>	256.0	ug.mL-1	PMID[18056283]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	>	256.0	ug.mL-1	PMID[19884373]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	2.0	ug.mL-1	PMID[19884377]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	2.0	ug.mL-1	PMID[19884377]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	8.0	ug.mL-1	PMID[19884377]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	256.0	ug.mL-1	PMID[19884377]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	4.0	ug.mL-1	PMID[19884377]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	16.0	ug.mL-1	PMID[19884377]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	>	2048.0	ug.mL-1	PMID[19901092]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	>	512.0	ug.mL-1	PMID[19917750]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	>	256.0	ug.mL-1	PMID[18227185]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	4.0	ug.mL-1	PMID[18299404]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	>	512.0	ug.mL-1	PMID[18299404]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	=	512.0	ug.mL-1	PMID[18316518]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	1.0	ug.mL-1	PMID[18362192]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	4.0	ug.mL-1	PMID[18362192]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	>	64.0	ug.mL-1	PMID[18362192]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	>	512.0	ug.mL-1	PMID[20086157]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	>	256.0	ug.mL-1	PMID[20086157]
NPT2894	Organism	Providencia rettgeri	Providencia rettgeri	MIC	>	256.0	ug.mL-1	PMID[20086157]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	0.125	ug.mL-1	PMID[20124004]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	8.0	ug.mL-1	PMID[20124004]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	0.25	ug.mL-1	PMID[20308380]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	4.0	ug.mL-1	PMID[20308380]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	>	512.0	ug.mL-1	PMID[20308383]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	>	256.0	ug.mL-1	PMID[18644970]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	>	4096.0	ug.mL-1	PMID[18663019]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	=	1024.0	ug.mL-1	PMID[18663019]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	2.0	ug.mL-1	PMID[18765691]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	4.0	ug.mL-1	PMID[18765691]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	>	512.0	ug.mL-1	PMID[18765691]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	512.0	ug.mL-1	PMID[18765691]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	>	1024.0	ug.mL-1	PMID[20516281]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	16.0	ug.mL-1	PMID[20516281]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	256.0	ug.mL-1	PMID[20516281]
NPT6599	Organism	Pectobacterium atrosepticum	Pectobacterium atrosepticum	MIC	=	4.0	ug.mL-1	PMID[18443127]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	MIC	=	16.0	ug.mL-1	PMID[18474583]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	>	512.0	ug.mL-1	PMID[18519712]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	>	256.0	ug.mL-1	PMID[19104021]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	>	256.0	ug.mL-1	PMID[19104021]
NPT5751	Organism	Burkholderia cenocepacia	Burkholderia cenocepacia	MIC	=	512.0	ug.mL-1	PMID[19075063]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	>	256.0	ug.mL-1	PMID[19015330]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	4.0	ug.mL-1	PMID[19015330]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	MIC	=	32.0	ug.mL-1	PMID[19258280]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	>	256.0	ug.mL-1	PMID[19273683]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	>	256.0	ug.mL-1	PMID[19273683]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	8.0	ug.mL-1	PMID[19273683]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	128.0	ug.mL-1	PMID[19273683]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	32.0	ug.mL-1	PMID[19273683]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	2.0	ug.mL-1	PMID[19273683]
NPT1548	Organism	Pseudomonas aeruginosa PAO1	Pseudomonas aeruginosa PAO1	MIC	=	8.0	ug.mL-1	PMID[19752280]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	>	256.0	ug.mL-1	PMID[20547808]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	>	256.0	ug.mL-1	PMID[19581459]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	=	256.0	ug.mL-1	PMID[19581459]
NPT173	Organism	Klebsiella pneumoniae	Klebsiella pneumoniae	MIC	=	8.0	ug.mL-1	PMID[19581459]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	128.0	ug.mL-1	PMID[20547808]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	4.0	ug.mL-1	PMID[20145085]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	12.0	ug.mL-1	PMID[20145085]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	=	16.0	ug.mL-1	PMID[20145085]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	=	256.0	ug.mL-1	PMID[20145085]
NPT20529	Non-molecular	NON-PROTEIN TARGET	n.a.	MIC	>	256.0	ug.mL-1	PMID[20145085]
NPT1466	Organism	Escherichia coli K12	Escherichia coli K-12	MIC	>	256.0	ug.mL-1	PMID[20145085]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	512.0	ug.mL-1	PMID[17116662]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[17116662]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	2048.0	ug.mL-1	PMID[17220412]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[17220412]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	512.0	ug.mL-1	PMID[17242148]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1.0	ug.mL-1	PMID[17242148]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>=	256.0	ug.mL-1	PMID[17353248]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[17353248]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC50	>	64.0	ug.mL-1	PMID[17371815]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC90	>	64.0	ug.mL-1	PMID[17371815]
NPT19	Organism	Escherichia coli	Escherichia coli	Activity	=	100.0	%	PMID[17371815]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[17371815]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	4096.0	ug.mL-1	PMID[17371815]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>	64.0	ug.mL-1	PMID[17420207]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	Activity	=	28.5	%	PMID[17420207]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	512.0	ug.mL-1	PMID[17420213]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[17420213]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	8.0	ug.mL-1	PMID[17438056]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[17438056]
NPT16	Organism	Staphylococcus aureus	Staphylococcus aureus	MIC	=	32.0	ug.mL-1	PMID[17438056]
NPT16	Organism	Staphylococcus aureus	Staphylococcus aureus	MIC	=	512.0	ug.mL-1	PMID[17438056]
NPT16	Organism	Staphylococcus aureus	Staphylococcus aureus	MIC	=	1.0	ug.mL-1	PMID[17438056]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	512000.0	ug.mL-1	PMID[17846134]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1000.0	ug.mL-1	PMID[17846134]
NPT5579	Organism	Aeromonas punctata	Aeromonas caviae	MIC	=	2048.0	ug.mL-1	PMID[17938180]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	512.0	ug.mL-1	PMID[17938180]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1024.0	ug.mL-1	PMID[17938180]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[17938180]
NPT4080	Organism	Acinetobacter sp.	Acinetobacter sp.	MIC	>	128.0	ug.mL-1	PMID[17470660]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC50	=	32.0	ug.mL-1	PMID[17682106]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC90	=	256.0	ug.mL-1	PMID[17682106]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>	4.0	ug.mL-1	PMID[17682106]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	16.0	ug.mL-1	PMID[17682106]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	4.0	ug.mL-1	PMID[17682106]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	128.0	ug.mL-1	PMID[17682106]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>	256.0	ug.mL-1	PMID[17682106]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	32.0	ug.mL-1	PMID[17682106]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	64.0	ug.mL-1	PMID[17682106]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	Activity	=	10.8	%	PMID[17682106]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	Activity	=	77.5	%	PMID[17682106]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	2048.0	ug.mL-1	PMID[17709463]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[17709463]
NPT4802	Organism	Dialister pneumosintes	Dialister pneumosintes	MIC90	=	2.0	ug.mL-1	PMID[17923492]
NPT4802	Organism	Dialister pneumosintes	Dialister pneumosintes	MIC50	=	0.25	ug.mL-1	PMID[17923492]
NPT4802	Organism	Dialister pneumosintes	Dialister pneumosintes	MIC	<=	0.06	ug.mL-1	PMID[17923492]
NPT4802	Organism	Dialister pneumosintes	Dialister pneumosintes	Activity	<=	32.0	ug ml-1	PMID[17923492]
NPT4802	Organism	Dialister pneumosintes	Dialister pneumosintes	Activity	<=	16.0	ug ml-1	PMID[17923492]
NPT4803	Organism	Dialister propionicifaciens	Dialister propionicifaciens	MIC	<=	0.06	ug.mL-1	PMID[17923492]
NPT4804	Organism	Dialister invisus	Dialister invisus	MIC	=	0.25	ug.mL-1	PMID[17923492]
NPT4803	Organism	Dialister propionicifaciens	Dialister propionicifaciens	Activity	<=	32.0	ug ml-1	PMID[17923492]
NPT4804	Organism	Dialister invisus	Dialister invisus	Activity	<=	32.0	ug ml-1	PMID[17923492]
NPT4803	Organism	Dialister propionicifaciens	Dialister propionicifaciens	Activity	<=	16.0	ug ml-1	PMID[17923492]
NPT4804	Organism	Dialister invisus	Dialister invisus	Activity	<=	16.0	ug ml-1	PMID[17923492]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	Activity	=	11.0	%	PMID[17938181]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	Activity	=	34.0	%	PMID[17938181]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>	256.0	ug.mL-1	PMID[17938181]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	0.75	ug.mL-1	PMID[18070972]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[18070972]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[18056283]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[18056283]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>	512.0	ug.mL-1	PMID[19884378]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	512.0	ug.mL-1	PMID[19884378]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[19884378]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[19901091]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[19901091]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	2048.0	ug.mL-1	PMID[19901092]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[19901092]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	512.0	ug.mL-1	PMID[19917750]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[19917750]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	128.0	ug.mL-1	PMID[19901091]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>=	512.0	ug.mL-1	PMID[20065056]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>=	512.0	ug.mL-1	PMID[20065056]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[20065056]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	16.0	ug.mL-1	PMID[20065056]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	32.0	ug.mL-1	PMID[20065056]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[18227185]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>	256.0	ug.mL-1	PMID[18227185]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[18227185]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	0.38	ug.mL-1	PMID[18227185]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1.5	ug.mL-1	PMID[18227185]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	0.25	ug.mL-1	PMID[18227185]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	512.0	ug.mL-1	PMID[18299404]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[18316518]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1024.0	ug.mL-1	PMID[18316518]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	8.0	ug.mL-1	PMID[18316518]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[18362192]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[18362192]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	512.0	ug.mL-1	PMID[20086157]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	128.0	ug.mL-1	PMID[20086157]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[20086157]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[20086157]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[20086157]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	64.0	ug.mL-1	PMID[20124004]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[20124004]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1.0	ug.mL-1	PMID[20308380]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	512.0	ug.mL-1	PMID[20308380]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	512.0	ug.mL-1	PMID[20308383]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[20308383]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	<=	2.0	ug.mL-1	PMID[20211886]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1024.0	ug.mL-1	PMID[20211886]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	4096.0	ug.mL-1	PMID[20211886]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1.5	ug.mL-1	PMID[18625772]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[18625772]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[18644958]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[18644958]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	64.0	ug.mL-1	PMID[19001117]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	<=	16.0	ug.mL-1	PMID[19001117]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[19001118]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	256.0	ug.mL-1	PMID[19001118]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	64.0	ug.mL-1	PMID[19001118]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1.0	ug.mL-1	PMID[19001118]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[18644966]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[18644966]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	8.0	ug.mL-1	PMID[18644966]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[18644970]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[18644970]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2048.0	ug.mL-1	PMID[18663019]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	4096.0	ug.mL-1	PMID[18663019]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[18663019]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[18663019]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	256.0	ug.mL-1	PMID[18663019]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	128.0	ug.mL-1	PMID[18663019]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[18765691]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	512.0	ug.mL-1	PMID[18765691]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	128.0	ug.mL-1	PMID[20547814]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	256.0	ug.mL-1	PMID[20547814]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	512.0	ug.mL-1	PMID[20547814]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>	512.0	ug.mL-1	PMID[20547814]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	8.0	ug.mL-1	PMID[18443127]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[18443127]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	16.0	ug.mL-1	PMID[18474583]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	2.0	ug.mL-1	PMID[18474583]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	4.0	ug.mL-1	PMID[18474583]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	8.0	ug.mL-1	PMID[18474583]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	1120.0	ug.mL-1	PMID[18285485]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	20.0	ug.mL-1	PMID[18285485]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	514.0	ug.mL-1	PMID[18519712]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	512.0	ug.mL-1	PMID[18519712]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[18519712]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	515.0	ug.mL-1	PMID[18519712]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	8.0	ug.mL-1	PMID[18443121]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	1024.0	ug.mL-1	PMID[18443121]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	256.0	ug.mL-1	PMID[18443121]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[19104021]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[19104021]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	512.0	ug.mL-1	PMID[19075063]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[19075063]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	2.0	ug.mL-1	PMID[19258280]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	0.5	ug.mL-1	PMID[19258280]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	16.0	ug.mL-1	PMID[19258280]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	1.0	ug.mL-1	PMID[19258280]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	32.0	ug.mL-1	PMID[19258280]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[19380596]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	16.0	ug.mL-1	PMID[19380596]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[19380596]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	FC	=	64.0	n.a.	PMID[19258280]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[19273683]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[19273683]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	8.0	ug.mL-1	PMID[19273683]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	32.0	ug.mL-1	PMID[19273683]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[19273683]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>	256.0	ug.mL-1	PMID[19223629]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	32.0	ug.mL-1	PMID[19752280]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	128.0	ug.mL-1	PMID[19770279]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[19770279]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	256.0	ug.mL-1	PMID[19651915]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[19651915]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	64.0	ug.mL-1	PMID[20547808]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	8.0	ug.mL-1	PMID[20547808]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[20547808]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	256.0	ug.mL-1	PMID[20547808]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	128.0	ug.mL-1	PMID[20547808]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[20547808]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	16.0	ug.mL-1	PMID[20566763]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	32.0	ug.mL-1	PMID[20566763]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	64.0	ug.mL-1	PMID[20566763]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	>	512.0	ug.mL-1	PMID[20566763]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	512.0	ug.mL-1	PMID[19470510]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	2.0	ug.mL-1	PMID[19470510]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1.0	ug.mL-1	PMID[19470510]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	256.0	ug.mL-1	PMID[21041509]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	512.0	ug.mL-1	PMID[21041509]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	8.0	ug.mL-1	PMID[21041509]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[20696873]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	256.0	ug.mL-1	PMID[20696873]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	6.0	ug.mL-1	PMID[20696873]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	1.5	ug.mL-1	PMID[20696873]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	16.0	ug.mL-1	PMID[20696873]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	8.0	ug.mL-1	PMID[20696873]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	>	512.0	ug.mL-1	PMID[20823289]
NPT19	Organism	Escherichia coli	Escherichia coli	MIC	=	4.0	ug.mL-1	PMID[20823289]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC	=	8.0	ug.mL-1	PMID[26344592]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC90	>	128.0	ug.mL-1	PMID[28549219]
NPT18	Organism	Pseudomonas aeruginosa	Pseudomonas aeruginosa	MIC50	=	128.0	ug.mL-1	PMID[28549219]
NPT2	Others	Unspecified	n.a.	Ratio	=	450.0	/mM/s	PMID[17420213]
NPT2	Others	Unspecified	n.a.	FC	=	10.0	n.a.	PMID[17846134]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	>	128.0	ug.mL-1	PMID[17470660]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	>=	256.0	ug.mL-1	PMID[17606684]
NPT4842	Organism	Acinetobacter haemolyticus	Acinetobacter haemolyticus	MIC	>=	256.0	ug.mL-1	PMID[17606684]
NPT2	Others	Unspecified	n.a.	Ratio	=	8.0	n.a.	PMID[17709463]
NPT6514	Organism	Carnobacterium divergens	Carnobacterium divergens	MIC	=	24.0	ug.mL-1	PMID[18070972]
NPT6514	Organism	Carnobacterium divergens	Carnobacterium divergens	MIC	=	32.0	ug.mL-1	PMID[18070972]
NPT6514	Organism	Carnobacterium divergens	Carnobacterium divergens	MIC	=	128.0	ug.mL-1	PMID[18070972]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	8.0	ug.mL-1	PMID[18086852]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	1.0	ug.mL-1	PMID[18086852]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	>	256.0	ug.mL-1	PMID[18086852]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	>	256.0	ug.mL-1	PMID[19884362]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	8.0	ug.mL-1	PMID[19884373]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	6.0	ug.mL-1	PMID[19884373]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	2.0	ug.mL-1	PMID[19884373]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	16.0	ug.mL-1	PMID[19884373]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	12.0	ug.mL-1	PMID[19884373]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	24.0	ug.mL-1	PMID[19884373]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	>	256.0	ug.mL-1	PMID[19884373]
NPT1209	Organism	Pseudomonas fluorescens	Pseudomonas fluorescens	MIC	>	256.0	ug.mL-1	PMID[19901091]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	>	512.0	ug.mL-1	PMID[18299404]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	64.0	ug.mL-1	PMID[18299404]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	4.0	ug.mL-1	PMID[18299404]
NPT2	Others	Unspecified	n.a.	Ratio	=	2.5	n.a.	PMID[18362192]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	>	1024.0	ug.mL-1	PMID[18443121]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	16.0	ug.mL-1	PMID[18443121]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	256.0	ug.mL-1	PMID[18443121]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	8.0	ug.mL-1	PMID[18443121]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	32.0	ug.mL-1	PMID[19364869]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	>	256.0	ug.mL-1	PMID[19380596]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	8.0	ug.mL-1	PMID[19380596]
NPT2	Others	Unspecified	n.a.	Activity	=	94.0	%	PMID[19380596]
NPT2	Others	Unspecified	n.a.	Activity	=	100.0	%	PMID[19380596]
NPT4806	Organism	Campylobacter coli	Campylobacter coli	MIC	=	64.0	ug.mL-1	PMID[19506058]
NPT4806	Organism	Campylobacter coli	Campylobacter coli	MIC	=	32.0	ug.mL-1	PMID[19506058]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	>	256.0	ug.mL-1	PMID[19770279]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	4.0	ug.mL-1	PMID[19770279]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	>	256.0	ug.mL-1	PMID[20547808]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	8.0	ug.mL-1	PMID[20547808]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	64.0	ug.mL-1	PMID[20547808]
NPT4806	Organism	Campylobacter coli	Campylobacter coli	MIC50	=	64.0	ug.mL-1	PMID[19506058]
NPT4806	Organism	Campylobacter coli	Campylobacter coli	MIC90	=	128.0	ug.mL-1	PMID[19506058]
NPT4806	Organism	Campylobacter coli	Campylobacter coli	MIC	=	8.0	ug.mL-1	PMID[19506058]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	64.0	ug.mL-1	DOI[10.1039/C5MD00377F]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	>	64.0	ug.mL-1	DOI[10.1039/C5MD00377F]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	=	32.0	ug.mL-1	DOI[10.1039/C5MD00377F]
NPT747	Organism	Acinetobacter baumannii	Acinetobacter baumannii	MIC	<=	8.0	ug.mL-1	DOI[10.1039/C5MD00377F]

In vivo activity

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference

Experimental ADME

Experiment Model	Experiment Tissue	ADME Type	ADME Relation	ADME Value	ADME Unit	Reference

Experimental Toxicity

Quantitative toxicity

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

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

Categorical toxicity labels

Hepatotoxicity	Carcinogenicity	Mutagenicity	Cardiotoxicity	Respiratory Toxicity	Eye Irritation	Endocrine Disruption

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

Chemically structural similarity

Similar Active Natural Products in NPASS

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

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

● The left chart: Distribution of similarity level between NPC487966 and all remaining natural products in the NPASS database.
● The right table: Most similar natural products (Tc>=0.5 or Top200).

range	Tanimoto Coefficient
0-0.1	23780
0.1-0.2	25500
0.2-0.3	560
0.3-0.4	6
0.4-0.5	6
0.5-0.6	3
0.6-0.7	2
0.7-0.8	1
0.8-0.85	0
0.85-0.9	0
0.9-0.95	0
0.95-1	0

Similarity Score	Similarity Level	Natural Product ID
0.6885	Remote Similarity	NPC330588
0.6567	Remote Similarity	NPC487967
0.5522	Remote Similarity	NPC90478
0.5362	Remote Similarity	NPC468984
0.5211	Remote Similarity	NPC206980

Similar Clinical/Approved Drugs

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

● The left chart: Distribution of similarity level between NPC487966 and all drugs/candidates.
● The right table: Most similar clinical/approved drugs (Tc>=0.5 or Top200).

range	Tanimoto Coefficient
0-0.1	2476
0.1-0.2	6234
0.2-0.3	371
0.3-0.4	15
0.4-0.5	33
0.5-0.6	13
0.6-0.7	3
0.7-0.8	1
0.8-0.85	0
0.85-0.9	0
0.9-0.95	0
0.95-1	1

Similarity Score	Similarity Level	Drug ID	Developmental Stage
1.0	High Similarity	NPD1646	Phase 4
0.7377	Intermediate Similarity	NPD1645	Phase 1
0.6885	Remote Similarity	NPD2437	Phase 4
0.6818	Remote Similarity	NPD1644	Approved
0.6567	Remote Similarity	NPD2055	Phase 3
0.5522	Remote Similarity	NPD2049	Clinical (unspecified phase)
0.5522	Remote Similarity	NPD2051	Phase 4
0.5362	Remote Similarity	NPD2088	Phase 4
0.5294	Remote Similarity	NPD2515	Phase 4
0.5286	Remote Similarity	NPD2436	Approved
0.5254	Remote Similarity	NPD9578	Clinical (unspecified phase)
0.5211	Remote Similarity	NPD2097	Approved
0.5211	Remote Similarity	NPD2098	Phase 4
0.5195	Remote Similarity	NPD3271	Phase 4
0.5195	Remote Similarity	NPD3275	Phase 4
0.5143	Remote Similarity	NPD2053	Phase 4
0.5075	Remote Similarity	NPD1784	Phase 4
0.507	Remote Similarity	NPD3007	Phase 4

Bioactivity similarity

Similar Natural Products in NPASS

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

A: chemistry similarity

B: biological targets similarity

C: networks similarity

D: cell-based bioactivity similarity

E: similarity based on clinical data