ChEMBL ligand: CHEMBL1466 (Bishydroxycoumarin, Dicoumarol, Dicoumarolum, Dicumarol, NSC-17860, NSC-221570, NSC-41834)
aldo-keto reductase family 1 member B/Aldose reductase in Rat [ChEMBL: CHEMBL2622] [GtoPdb: 2768] [UniProtKB: P07943] There should be some charts here, you may need to enable JavaScript!
ATP phosphoribosyltransferase in Mycobacterium tuberculosis [ChEMBL: CHEMBL6086] [UniProtKB: P9WMN1] There should be some charts here, you may need to enable JavaScript!
CYP2C9/Cytochrome P450 2C9 in Human [ChEMBL: CHEMBL3397] [GtoPdb: 1326] [UniProtKB: P11712] There should be some charts here, you may need to enable JavaScript!
Enoyl-[acyl-carrier-protein] reductase [NADH] in Francisella tularensis subsp. tularensis (strain SCHU S4 / Schu 4) [ChEMBL: CHEMBL2150835] [UniProtKB: Q5NGQ3] There should be some charts here, you may need to enable JavaScript!
GPR35/G-protein coupled receptor 35 in Human [ChEMBL: CHEMBL1293267] [GtoPdb: 102] [UniProtKB: Q9HC97] There should be some charts here, you may need to enable JavaScript!
Human immunodeficiency virus type 1 integrase in Human immunodeficiency virus 1 [ChEMBL: CHEMBL3471] [UniProtKB: Q7ZJM1] There should be some charts here, you may need to enable JavaScript!
mitogen-activated protein kinase 1/MAP kinase ERK2 in Human [ChEMBL: CHEMBL4040] [GtoPdb: 1495] [UniProtKB: P28482] There should be some charts here, you may need to enable JavaScript!
NAD(P)H dehydrogenase [quinone] 1 in Rat [ChEMBL: CHEMBL3091269] [UniProtKB: P05982] There should be some charts here, you may need to enable JavaScript!
Quinone reductase 1 in Human [ChEMBL: CHEMBL3623] [UniProtKB: P15559] There should be some charts here, you may need to enable JavaScript!
proprotein convertase subtilisin/kexin type 7/Subtilisin/kexin type 7 in Human [ChEMBL: CHEMBL2232] [GtoPdb: 2387] [UniProtKB: Q16549] There should be some charts here, you may need to enable JavaScript!
Urease in Canavalia ensiformis [ChEMBL: CHEMBL4161] [UniProtKB: P07374] There should be some charts here, you may need to enable JavaScript!

DB	Assay description	Assay Type	Standard value	Standard parameter	Original value	Original units	Original parameter	Reference
aldo-keto reductase family 1 member B/Aldose reductase in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2622] [GtoPdb: 2768] [UniProtKB: P07943]
ChEMBL	DRUGMATRIX: Aldose Reductase enzyme inhibition (substrate: DL-Glyceraldehyde)	B	5.39	pIC50	4093	nM	IC50	DrugMatrix in vitro pharmacology data
ATP phosphoribosyltransferase in Mycobacterium tuberculosis (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6086] [UniProtKB: P9WMN1]
ChEMBL	Inhibition of Mycobacterium tuberculosis HisG assessed as phosphoribosyl ATP production by spectrophotometry	B	4.22	pKi	60000	nM	Ki	J Med Chem (2008) 51: 5984-5992 [PMID:18778048]
CYP2C9/Cytochrome P450 2C9 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3397] [GtoPdb: 1326] [UniProtKB: P11712]
ChEMBL	DRUGMATRIX: CYP450, 2C9 enzyme inhibition (substrate: 3-Cyano-7-ethoxycoumarin)	B	6.52	pIC50	300	nM	IC50	DrugMatrix in vitro pharmacology data
Enoyl-[acyl-carrier-protein] reductase [NADH] in Francisella tularensis subsp. tularensis (strain SCHU S4 / Schu 4) (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2150835] [UniProtKB: Q5NGQ3]
ChEMBL	Inhibition of C-terminal His6-tagged Francisella tularensis SCHU S4 FabI expressed in Escherichia coli BL21 (DE3) using CrCoA as substrate assessed as oxidation of NADH to NAD+ by fluorescence assay	B	4.33	pIC50	47000	nM	IC50	J Med Chem (2013) 56: 5275-5287 [PMID:23815100]
GPR35/G-protein coupled receptor 35 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1293267] [GtoPdb: 102] [UniProtKB: Q9HC97]
ChEMBL	Displacement of [3H]PSB-13253 from human recombinant GPR35 exprssed in CHO cells by liquid scintillation counting analysis	B	7.41	pKi	39	nM	Ki	J Med Chem (2013) 56: 7084-7099 [PMID:23888932]
ChEMBL	Agonist activity at C-terminal beta-galactosidase tagged human recombinant GPR35 expressed in CHO cells after 90 mins by beta-arrestin recruitment assay	B	5.01	pEC50	9780	nM	EC50	J Med Chem (2013) 56: 7084-7099 [PMID:23888932]
ChEMBL	Agonist activity at human GPR35 expressed in HEK293T cells at 5 uM by EYPF-based beta-arrestin-2 luciferase reporter gene assay	B	5.89	pEC50	1300	nM	EC50	J Med Chem (2013) 56: 7084-7099 [PMID:23888932]
ChEMBL	Agonist activity at human GPR35 expressed in CHO-K1 cells after 90 mins by beta-arrestin 2 recruitment assay	B	5.89	pEC50	1300	nM	EC50	J Med Chem (2017) 60: 362-372 [PMID:27976894]
Human immunodeficiency virus type 1 integrase in Human immunodeficiency virus 1 (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3471] [UniProtKB: Q7ZJM1]
ChEMBL	Inhibitory activity against 3'-processing of DNA by HIV-1 integrase	F	4	pIC50	>100000	nM	IC50	J Med Chem (1997) 40: 242-249 [PMID:9003523]
ChEMBL	Integration of DNA by HIV -1 integrase	B	4	pIC50	>100000	nM	IC50	J Med Chem (1997) 40: 242-249 [PMID:9003523]
mitogen-activated protein kinase 1/MAP kinase ERK2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4040] [GtoPdb: 1495] [UniProtKB: P28482]
ChEMBL	DRUGMATRIX: Protein Serine/Threonine Kinase, ERK2 enzyme inhibition (substrate: Myelin Basic Protein)	B	5.35	pIC50	4426	nM	IC50	DrugMatrix in vitro pharmacology data
NAD(P)H dehydrogenase [quinone] 1 in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3091269] [UniProtKB: P05982]
ChEMBL	Competitive binding affinity to rat liver NQO1 in presence of NADPH	B	9	pKi	1	nM	Ki	J Med Chem (2018) 61: 6983-7003 [PMID:29712428]
Quinone reductase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3623] [UniProtKB: P15559]
ChEMBL	Inhibition of human recombinant NQO1	B	6.35	pIC50	450	nM	IC50	Bioorg Med Chem Lett (2006) 16: 6246-6254 [PMID:17011189]
ChEMBL	Inhibition of human recombinant NQO1 in presence of BSA	B	6.35	pIC50	450	nM	IC50	J Med Chem (2007) 50: 6316-6325 [PMID:17999461]
ChEMBL	Inhibition of human recombinant NQO1 in presence of BSA	B	6.39	pIC50	404	nM	IC50	J Med Chem (2009) 52: 7142-7156 [PMID:19877692]
ChEMBL	Inhibition of recombinant human NQO1 assessed as reduction in oxidation of NADPH to NADP+ using b-lap as substrate and NADPH in presence of 0.14% (w/v) BSA	B	6.46	pIC50	350	nM	IC50	Eur J Med Chem (2017) 127: 828-839 [PMID:27829520]
ChEMBL	Inhibition of human recombinant NQO1	B	8.3	pIC50	5	nM	IC50	J Med Chem (2007) 50: 6316-6325 [PMID:17999461]
ChEMBL	Inhibition of human recombinant NQO1	B	8.59	pIC50	2.6	nM	IC50	J Med Chem (2009) 52: 7142-7156 [PMID:19877692]
proprotein convertase subtilisin/kexin type 7/Subtilisin/kexin type 7 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2232] [GtoPdb: 2387] [UniProtKB: Q16549]
ChEMBL	Inhibition of recombinant type 8 subtilisin using Arg-Glu-(EDANS)- Ser-Gln-Asn-Tyr-Pro-Ile-Val-Gln-Lys-(DALBCYL)-Arg fluorogenic substrate preincubated for 1 hr measured after 1 hr at 1 min interval by fluorescence assay	B	5.89	pIC50	1300	nM	IC50	J Nat Prod (2011) 74: 1353-1357 [PMID:21510613]
Urease in Canavalia ensiformis (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4161] [UniProtKB: P07374]
ChEMBL	Inhibition of jack bean urease	B	4.82	pIC50	15135.61	nM	IC50	Bioorg Med Chem (2008) 16: 3456-3461 [PMID:18280742]
ChEMBL	Inhibition of jack bean urease	B	4.82	pIC50	15010	nM	IC50	Eur J Med Chem (2022) 234: 114273-114273 [PMID:35305460]

ChEMBL data shown on this page come from version 34:

Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]