BDBM50055710 4-HYDROXY-2H-CHROMEN-2-ONE::4-Hydroxy-chromen-2-one::4-hydroxycoumarin::CHEMBL301141

SMILES Oc1cc(=O)oc2ccccc12

InChI Key InChIKey=VXIXUWQIVKSKSA-UHFFFAOYSA-N

Data  4 KI  5 IC50

PDB links: 3 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 50055710   

TargetCarbonic anhydrase 9(Homo sapiens (Human))
Universit£ degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM50055710(4-HYDROXY-2H-CHROMEN-2-ONE | 4-Hydroxy-chromen-2-o...)
Show SMILES Oc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H
Affinity DataKi:  410nMAssay Description:Inhibition of human carbonic anhydrase 9 catalytic domain by Stopped-Flow CO2 Hydrase assayMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 12(Homo sapiens (Human))
Universit£ degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM50055710(4-HYDROXY-2H-CHROMEN-2-ONE | 4-Hydroxy-chromen-2-o...)
Show SMILES Oc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H
Affinity DataKi:  6.30E+3nMAssay Description:Inhibition of human carbonic anhydrase 12 catalytic domain by Stopped-Flow CO2 Hydrase assayMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Universit£ degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM50055710(4-HYDROXY-2H-CHROMEN-2-ONE | 4-Hydroxy-chromen-2-o...)
Show SMILES Oc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H
Affinity DataKi:  9.50E+4nMAssay Description:Inhibition of human carbonic anhydrase 1 by Stopped-Flow CO2 Hydrase assayMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£ degli Studi di Firenze

Curated by ChEMBL
LigandPNGBDBM50055710(4-HYDROXY-2H-CHROMEN-2-ONE | 4-Hydroxy-chromen-2-o...)
Show SMILES Oc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of human carbonic anhydrase 2 by Stopped-Flow CO2 Hydrase assayMore data for this Ligand-Target Pair
TargetIntegrase(Human immunodeficiency virus 1)
National Cancer Institute-Bethesda

Curated by ChEMBL
LigandPNGBDBM50055710(4-HYDROXY-2H-CHROMEN-2-ONE | 4-Hydroxy-chromen-2-o...)
Show SMILES Oc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibitory activity against 3'-processing of DNA by HIV-1 integraseMore data for this Ligand-Target Pair
TargetSorbitol dehydrogenase(Homo sapiens (Human))
University of Toyama

Curated by ChEMBL
LigandPNGBDBM50055710(4-HYDROXY-2H-CHROMEN-2-ONE | 4-Hydroxy-chromen-2-o...)
Show SMILES Oc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H
Affinity DataIC50: 4.00E+5nMAssay Description:Inhibition sorbitol dehydrogenase by spectrophotometric analysisMore data for this Ligand-Target Pair
TargetIntegrase(Human immunodeficiency virus 1)
National Cancer Institute-Bethesda

Curated by ChEMBL
LigandPNGBDBM50055710(4-HYDROXY-2H-CHROMEN-2-ONE | 4-Hydroxy-chromen-2-o...)
Show SMILES Oc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H
Affinity DataIC50: 1.00E+5nMAssay Description:Integration of DNA by HIV -1 integraseMore data for this Ligand-Target Pair
TargetAldo-keto reductase family 1 member B1(Homo sapiens (Human))
University of Toyama

Curated by ChEMBL
LigandPNGBDBM50055710(4-HYDROXY-2H-CHROMEN-2-ONE | 4-Hydroxy-chromen-2-o...)
Show SMILES Oc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H
Affinity DataIC50: 4.00E+5nMAssay Description:Inhibition human recombinant aldose reductase 1 by spectrophotometric analysisMore data for this Ligand-Target Pair
TargetXanthine dehydrogenase/oxidase(Homo sapiens (Human))
Università di Modena e Reggio Emilia

Curated by ChEMBL
LigandPNGBDBM50055710(4-HYDROXY-2H-CHROMEN-2-ONE | 4-Hydroxy-chromen-2-o...)
Show SMILES Oc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H
Affinity DataIC50: 1.95E+5nMAssay Description:Inhibition of xanthine oxidaseMore data for this Ligand-Target Pair