BDBM50335808 2,5-Dihydroxybenzoate, VI::2,5-dihydroxybenzoic acid::CHEMBL1461::gentisic acid

SMILES OC(=O)c1cc(O)ccc1O

InChI Key InChIKey=WXTMDXOMEHJXQO-UHFFFAOYSA-N

Data  7 KI  4 IC50

PDB links: 7 PDB IDs match this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 11 hits for monomerid = 50335808   

TargetCarbonic anhydrase 2(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50335808(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)
Affinity DataKi:  4.10E+3nMAssay Description:Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by CO2 hydration stopped-flow assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMedPDB3D3D Structure (crystal)

TargetCarbonic anhydrase 1(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50335808(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)
Affinity DataKi:  4.20E+3nMAssay Description:Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by CO2 hydration stopped-flow assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetCarbonic anhydrase 9(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50335808(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)
Affinity DataKi:  6.60E+3nMAssay Description:Inhibition of human carbonic anhydrase 9 preincubated for 15 mins by CO2 hydration stopped-flow assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetCarbonic anhydrase 12(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50335808(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)
Affinity DataKi:  7.30E+3nMAssay Description:Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by CO2 hydration stopped-flow assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetCarbonic anhydrase 14(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50335808(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)
Affinity DataKi:  6.70E+4nMAssay Description:Inhibition of human carbonic anhydrase 14 preincubated for 15 mins by CO2 hydration stopped-flow assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetCarbonic anhydrase 7(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50335808(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)
Affinity DataKi:  6.80E+4nMAssay Description:Inhibition of human carbonic anhydrase 7 preincubated for 15 mins by CO2 hydration stopped-flow assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetProlyl 4-hydroxylase subunit alpha-1(Chicken)
University of Oulu

LigandPNGBDBM50335808(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)
Affinity DataKi:  1.40E+6nMAssay Description:Inhibition assay using procollagen-prolin, 2-oxoglutarate 4-dioxygenase.More data for this Ligand-Target Pair
In DepthDetails PubMed

TargetTyrosine-protein phosphatase non-receptor type 1(Human)
East China University of Science and Technology

Curated by ChEMBL
LigandPNGBDBM50335808(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)
Affinity DataIC50: >1.00E+5nMAssay Description:Inhibition of human recombinant PTP1B expressed in CHO cells assessed as p-nitorphenol production after 2 mins by microplate readerMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetPolyunsaturated fatty acid 5-lipoxygenase(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50335808(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)
Affinity DataIC50:  7.50E+4nMAssay Description:Inhibition of human recombinant 5-lipoxygenase after 10 mins by fluorescence assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetAlpha-(1,3)-fucosyltransferase 7(Human)
Schering-Plough Research Institute

LigandPNGBDBM50335808(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)
Affinity DataIC50:  1.15E+5nMpH: 7.3 T: 22°CAssay Description:A radioligand-binding assay was developed using scintillation proximity assay (SPA) technology. The wheat germ agglutinin SPA beads (Amersham) (0.2 m...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetCarbonic anhydrase 2(Human)
Universita Degli Studi Di Firenze

Curated by ChEMBL
LigandPNGBDBM50335808(2,5-Dihydroxybenzoate, VI | 2,5-dihydroxybenzoic a...)
Affinity DataIC50:  5.00E+6nMAssay Description:Inhibition of human carbonic anhydrase isozyme 2 pre-incubated for 10 mins before 4-nitrophenylacetate substrate additionMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMedPDB3D3D Structure (crystal)