BDBM50406452 CHEMBL106848

SMILES NS(=O)(=O)c1ccc(SCCO)cc1

InChI Key InChIKey=LTXDVFFEVZJDGT-UHFFFAOYSA-N

Data  1 KI  1 IC50  10 Kd

PDB links: 1 PDB ID matches this monomer.

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 50406452   

TargetCarbonic anhydrase 2(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataKi:  21nMAssay Description:Inhibition of human recombinant CA2 incubated for 15 mins by stop flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 13(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataKd:  1.00E+3nMpH: 7.0Assay Description:Binding affinity to human recombinant CA13 at 37 degC and pH 7.0 by isothermal titration calorimetryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 12(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataKd:  1.50E+3nMpH: 7.0Assay Description:Binding affinity to human recombinant CA12 at 37 degC and pH 7.0 by isothermal titration calorimetryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 7(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataKd:  510nMpH: 7.0Assay Description:Binding affinity to human recombinant CA7 at 37 degC and pH 7.0 by isothermal titration calorimetryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataKd:  200nMpH: 7.0Assay Description:Binding affinity to human recombinant CA1 at 37 degC and pH 7.0 by thermal shift assayMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataKd:  790nMpH: 7.0Assay Description:Binding affinity to human recombinant CA1 at 37 degC and pH 7.0 by isothermal titration calorimetryMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 13(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataKd:  1.40E+3nMpH: 7.0Assay Description:Binding affinity to human recombinant CA13 at 37 degC and pH 7.0 by thermal shift assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 12(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataKd:  2.50E+3nMpH: 7.0Assay Description:Binding affinity to human recombinant CA12 at 37 degC and pH 7.0 by thermal shift assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 7(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataKd:  170nMpH: 7.0Assay Description:Binding affinity to human recombinant CA7 at 37 degC and pH 7.0 by thermal shift assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataKd:  130nMpH: 7.0Assay Description:Binding affinity to human recombinant CA2 at 37 degC and pH 7.0 by thermal shift assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataIC50:  60nMAssay Description:Inhibition of human recombinant CA2 incubated for 15 mins by stop flow CO2 hydration assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Vilnius University Institute Of Biotechnology

Curated by ChEMBL
LigandPNGBDBM50406452(CHEMBL106848)
Affinity DataKd:  330nMpH: 7.0Assay Description:Binding affinity to human recombinant CA2 at 37 degC and pH 7.0 by isothermal titration calorimetryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed