BDBM50097277 ((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfamoyl-phenyl)-ethylcarbamoyl]-methyl}-amino)-ethyl]-amino}-ethyl)-{[2-(4-sulfamoyl-phenyl)-ethylcarbamoyl]-methyl}-amino)-acetic acid::((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfamoyl-phenyl)-ethylcarbamoyl]-methyl}-amino)-ethyl]-amino}-ethyl)-{[2-(4-sulfamoyl-phenyl)-ethylcarbamoyl]-methyl}-amino)-acetic acid;compound with Zn complex::CHEMBL1795062::CHEMBL286862::Zinc; ((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfamoyl-phenyl)-ethylcarbamoyl]-methyl}-amino)-ethyl]-amino}-ethyl)-{[2-(4-sulfamoyl-phenyl)-ethylcarbamoyl]-methyl}-amino)-acetic acid

SMILES NS(=O)(=O)c1ccc(CCNC(=O)CN(CCN(CCN(CC(O)=O)CC(=O)NCCc2ccc(cc2)S(N)(=O)=O)CC(O)=O)CC(O)=O)cc1

InChI Key InChIKey=GTBRQIOYGMBQQS-UHFFFAOYSA-N

Data  16 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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 16 hits for monomerid = 50097277   

TargetCarbonic anhydrase 12(Homo sapiens (Human))
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  3.90nMAssay Description:Inhibition of human recombinant CA12 by CO2 hydration stopped flow assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  7nMAssay Description:Inhibition of cloned isozyme, human carbonic anhydrase IIMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  7nMAssay Description:Inhibitory activity against Human carbonic anhydrase IIMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  7.5nMAssay Description:Inhibition of human recombinant CA9 by CO2 hydration stopped flow assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  8nMAssay Description:Inhibition of hepatitis c virus Non structural protein 3 protease/Non structural protein 4A proteaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  8nMAssay Description:Inhibitory activity against Human carbonic anhydrase IIMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  9.5nMAssay Description:Inhibition of human recombinant CA1 by CO2 hydration stopped flow assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  11.4nMAssay Description:Inhibition of human recombinant CA2 by CO2 hydration stopped flow assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 4(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  16nMAssay Description:Inhibitory activity against human recombinant Cdc25B phosphatase enzymeMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 4(Bos taurus (bovine))
Universit£

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  16nMAssay Description:Inhibitory activity against bovine carbonic anhydrase IVMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 4(Bos taurus (bovine))
Universit£

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  25nMAssay Description:Inhibitory activity against bovine carbonic anhydrase IVMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 4(Homo sapiens (Human))
Universit£

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  25nMAssay Description:Inhibition of cloned isozyme, human carbonic anhydrase IVMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  36nMAssay Description:Inhibition of cloned isozyme, human carbonic anhydrase IMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  36nMAssay Description:Inhibitory activity against Human carbonic anhydrase IMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  170nMAssay Description:In vitro binding affinity of the compound towards cloned rat 5-hydroxytryptamine 7 receptor using [3H]-5-HT as radioligandMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50097277(((2-{Carboxymethyl-[2-(carboxymethyl-{[2-(4-sulfam...)
Affinity DataKi:  170nMAssay Description:Inhibitory activity against Human carbonic anhydrase IMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed