ChEMBL ligand: CHEMBL244743 (6,7-Dihydroxycoumarin, Esculetin)
aldo-keto reductase family 1 member B/Aldose reductase in Human [ChEMBL: CHEMBL1900] [GtoPdb: 2768] [UniProtKB: P15121] There should be some charts here, you may need to enable JavaScript!
carbonic anhydrase 9/Carbonic anhydrase IX in Human [ChEMBL: CHEMBL3594] [GtoPdb: 3055] [UniProtKB: Q16790] There should be some charts here, you may need to enable JavaScript!
carbonic anhydrase 12/Carbonic anhydrase XII in Human [ChEMBL: CHEMBL3242] [GtoPdb: 2747] [UniProtKB: O43570] There should be some charts here, you may need to enable JavaScript!
COX-1 /Cyclooxygenase-1 in Human [ChEMBL: CHEMBL221] [GtoPdb: 1375] [UniProtKB: P23219] There should be some charts here, you may need to enable JavaScript!
MCL1 apoptosis regulator, BCL2 family member/Induced myeloid leukemia cell differentiation protein Mcl-1 in Human [ChEMBL: CHEMBL4361] [GtoPdb: 2847] [UniProtKB: Q07820] There should be some charts here, you may need to enable JavaScript!
lysine demethylase 5B/Lysine-specific demethylase 5B in Human [ChEMBL: CHEMBL3774295] [GtoPdb: 2681] [UniProtKB: Q9UGL1] There should be some charts here, you may need to enable JavaScript!
Sorbitol dehydrogenase in Human [ChEMBL: CHEMBL2275] [UniProtKB: Q00796] There should be some charts here, you may need to enable JavaScript!
Sortase A in S.aureus [ChEMBL: CHEMBL5362] [UniProtKB: Q9S446] There should be some charts here, you may need to enable JavaScript!
xanthine dehydrogenase/Xanthine dehydrogenase in Human [ChEMBL: CHEMBL1929] [GtoPdb: 2646] [UniProtKB: P47989] There should be some charts here, you may need to enable JavaScript!
CYP2A6 in Human [GtoPdb: 1321] [UniProtKB: P11509] 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 Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1900] [GtoPdb: 2768] [UniProtKB: P15121]
ChEMBL	Inhibition human recombinant aldose reductase 1 by spectrophotometric analysis	B	4.17	pIC50	67200	nM	IC50	Bioorg Med Chem Lett (2010) 20: 5630-5633 [PMID:20805028]
carbonic anhydrase 9/Carbonic anhydrase IX in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3594] [GtoPdb: 3055] [UniProtKB: Q16790]
ChEMBL	Inhibition of human carbonic anhydrase 9 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay	B	7.44	pKi	36.4	nM	Ki	Eur J Med Chem (2018) 143: 276-282 [PMID:29197732]
carbonic anhydrase 12/Carbonic anhydrase XII in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3242] [GtoPdb: 2747] [UniProtKB: O43570]
ChEMBL	Inhibition of human carbonic anhydrase 12 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assay	B	8.03	pKi	9.3	nM	Ki	Eur J Med Chem (2018) 143: 276-282 [PMID:29197732]
COX-1 /Cyclooxygenase-1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL221] [GtoPdb: 1375] [UniProtKB: P23219]
ChEMBL	Inhibition of COX1	B	4.24	pIC50	57000	nM	IC50	J Nat Prod (2005) 68: 985-991 [PMID:16038536]
MCL1 apoptosis regulator, BCL2 family member/Induced myeloid leukemia cell differentiation protein Mcl-1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4361] [GtoPdb: 2847] [UniProtKB: Q07820]
ChEMBL	Displacement of FAM-Bid peptide from recombinant N-terminal His6x-tagged human Mcl-1 expressed in Escherichia coli BL21 (DE3) incubated for 30 mins by fluorescence polarization assay	B	5.83	pKi	1490	nM	Ki	Bioorg Med Chem (2021) 29: 115851-115851 [PMID:33218896]
ChEMBL	Displacement of FAM-Bid peptide from recombinant N-terminal His6x-tagged human Mcl-1 expressed in Escherichia coli BL21 (DE3) incubated for 30 mins by fluorescence polarization assay	B	5.06	pIC50	8770	nM	IC50	Bioorg Med Chem (2021) 29: 115851-115851 [PMID:33218896]
lysine demethylase 5B/Lysine-specific demethylase 5B in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3774295] [GtoPdb: 2681] [UniProtKB: Q9UGL1]
ChEMBL	Inhibition of KDM5B (unknown origin)	B	5.34	pIC50	4600	nM	IC50	Eur J Med Chem (2020) 208: 112760-112760 [PMID:32883639]
Sorbitol dehydrogenase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2275] [UniProtKB: Q00796]
ChEMBL	Inhibition sorbitol dehydrogenase by spectrophotometric analysis	B	4.08	pIC50	82900	nM	IC50	Bioorg Med Chem Lett (2010) 20: 5630-5633 [PMID:20805028]
Sortase A in S.aureus (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5362] [UniProtKB: Q9S446]
ChEMBL	Inhibition of Staphylococcus aureus SrtA using FRET substrate incubated for 1 hr by FRET assay	B	4.44	pIC50	36160	nM	IC50	J Med Chem (2021) 64: 13097-13130 [PMID:34516107]
xanthine dehydrogenase/Xanthine dehydrogenase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1929] [GtoPdb: 2646] [UniProtKB: P47989]
ChEMBL	Inhibition of xanthine oxidase	B	5.09	pIC50	8200	nM	IC50	Eur J Med Chem (2007) 42: 1028-1031 [PMID:17316915]
CYP2A6 in Human [GtoPdb: 1321] [UniProtKB: P11509]
GtoPdb	-	-	6.41	pIC50	390	nM	IC50	Eur J Pharm Sci (2019) 136: 104944 [PMID:31163215]

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]