BDBM10859 4-methylbenzene-1-sulfonamide::CHEMBL574::aromatic/heteroaromatic sulfonamide 4::hCA inhibitor, 7

SMILES Cc1ccc(cc1)S(N)(=O)=O

InChI Key InChIKey=LMYRWZFENFIFIT-UHFFFAOYSA-N

Data  89 KI  5 IC50  4 Kd  2 Koff

PDB links: 4 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 20 hits for monomerid = 10859   

TargetCarbonic anhydrase 2(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  320nM ΔG°:  -8.85kcal/molepH: 7.5 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  320nMAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  320nMAssay Description:Inhibition of human recombinant cytosolic isozyme CA II by stopped-flow CO2 hydrase methodMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  320nMAssay Description:Inhibition of human recombinant CA2More data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  320nMpH: 7.5Assay Description:Inhibition of human recombinant carbonic anhydrase 2 at pH 7.5 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  320nMAssay Description:Inhibition of human carbonic anhydrase-2 by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
TargetCARBONIC ANHYDRASE(Helicobacter pylori J99)
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  450nMAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Kochi Medical School

Curated by ChEMBL
LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  460nMAssay Description:Inhibition of catalytic domain of human recombinant CA IXMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase(Helicobacter pylori (strain G27))
Kochi Medical School

Curated by ChEMBL
LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  473nMAssay Description:Inhibition of Helicobacter pylori recombinant CAMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 6(Homo sapiens (Human))
Kochi Medical School

Curated by ChEMBL
LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  1.58E+3nMAssay Description:Inhibition of full length human recombinant CA VIMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 5B, mitochondrial(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  2.43E+3nMAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 5A, mitochondrial(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  4.70E+3nMAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetBeta-carbonic anhydrase 1(Mycobacterium tuberculosis)
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  4.92E+3nM ΔG°:  -7.11kcal/molepH: 8.3 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase(Mycobacterium tuberculosis)
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  7.02E+3nM ΔG°:  -6.91kcal/molepH: 8.3 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 3(Homo sapiens (Human))
Kochi Medical School

Curated by ChEMBL
LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  7.90E+3nMAssay Description:Inhibition of human recombinant CA 3 assessed as CO2 hydration by stopped flow kinetic assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  7.85E+4nM ΔG°:  -5.60kcal/molepH: 7.5 T: 2°CAssay Description:An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  7.85E+4nMAssay Description:Inhibition of human carbonic anhydrase-1 by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  7.85E+4nMpH: 7.5Assay Description:Inhibition of human recombinant carbonic anhydrase 1 at pH 7.5 by stopped flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  7.85E+4nMAssay Description:Inhibition of human recombinant CA1More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Kochi Medical School

LigandPNGBDBM10859(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Affinity DataKi:  7.85E+4nMAssay Description:Inhibition of human recombinant cytosolic isozyme CA I by stopped-flow CO2 hydrase methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed