BDBM50208755 1-(2-chloro-4-sulfamoylphenyl)-3-{[(1R,2S,6S,9R)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.0^{2,6}]dodecan-6-yl]methyl}thiourea::CHEMBL232816

SMILES CC1(C)O[C@@H]2CO[C@@]3(CNC(=S)Nc4ccc(cc4Cl)S(N)(=O)=O)OC(C)(C)O[C@H]3[C@@H]2O1

InChI Key InChIKey=JRTAARITAXOAAO-UHFFFAOYSA-N

Data  7 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 7 hits for monomerid = 50208755   

TargetCarbonic anhydrase 2(Human)
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50208755(1-(2-chloro-4-sulfamoylphenyl)-3-{[(1R,2S,6S,9R)-4...)
Affinity DataKi:  11nMAssay Description:Inhibition of human recombinant CA2 after 15 mins by CO2 hydration stopped flow assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 7(Human)
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50208755(1-(2-chloro-4-sulfamoylphenyl)-3-{[(1R,2S,6S,9R)-4...)
Affinity DataKi:  18nMAssay Description:Inhibition of human recombinant CA7 after 15 mins by CO2 hydration stopped flow assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 9(Human)
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50208755(1-(2-chloro-4-sulfamoylphenyl)-3-{[(1R,2S,6S,9R)-4...)
Affinity DataKi:  134nMAssay Description:Inhibition of human recombinant CA9 after 15 mins by CO2 hydration stopped flow assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 14(Human)
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50208755(1-(2-chloro-4-sulfamoylphenyl)-3-{[(1R,2S,6S,9R)-4...)
Affinity DataKi:  630nMAssay Description:Inhibition of human recombinant CA14 after 15 mins by CO2 hydration stopped flow assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 5A, mitochondrial(Human)
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50208755(1-(2-chloro-4-sulfamoylphenyl)-3-{[(1R,2S,6S,9R)-4...)
Affinity DataKi:  940nMAssay Description:Inhibition of human recombinant CA5A after 15 mins by CO2 hydration stopped flow assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 4(Human)
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50208755(1-(2-chloro-4-sulfamoylphenyl)-3-{[(1R,2S,6S,9R)-4...)
Affinity DataKi:  1.04E+3nMAssay Description:Inhibition of human recombinant CA4 after 15 mins by CO2 hydration stopped flow assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
Ecole Nationale Sup£Rieure De Chimie De Montpellier

Curated by ChEMBL
LigandPNGBDBM50208755(1-(2-chloro-4-sulfamoylphenyl)-3-{[(1R,2S,6S,9R)-4...)
Affinity DataKi:  1.23E+4nMAssay Description:Inhibition of human recombinant CA1 after 15 mins by CO2 hydration stopped flow assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/11/2012
Entry Details Article
PubMed