BDBM14721 2,6-di-tert-butyl-4-methyl-1-{4-[(5-sulfamoyl-1,3,4-thiadiazol-2-yl)sulfamoyl]phenyl}-1-pyridin-1-ylium perchlorate::pyridinium-containing sulfonamide analog 14d

SMILES Cc1cc([n+](-c2ccc(cc2)S(=O)(=O)Nc2nnc(s2)S(N)(=O)=O)c(c1)C(C)(C)C)C(C)(C)C

InChI Key InChIKey=RTDKCBFGVNJKCZ-UHFFFAOYSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 14721   

TargetCarbonic anhydrase 2(Homo sapiens (Human))
Canadian Institutes Of Health Research

LigandPNGBDBM14721(2,6-di-tert-butyl-4-methyl-1-{4-[(5-sulfamoyl-1,3,...)
Affinity DataKi:  3.13nMAssay Description:Initial rates of 4-nitrophenyl acetate hydrolysis catalyzed by different CA isozymes were monitored spectrophotometrically at 400 nm. A molar absorpt...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 4(Bos taurus (bovine))
Canadian Institutes Of Health Research

LigandPNGBDBM14721(2,6-di-tert-butyl-4-methyl-1-{4-[(5-sulfamoyl-1,3,...)
Affinity DataKi:  9.40nMAssay Description:Initial rates of 4-nitrophenyl acetate hydrolysis catalyzed by different CA isozymes were monitored spectrophotometrically at 400 nm. A molar absorpt...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Canadian Institutes Of Health Research

LigandPNGBDBM14721(2,6-di-tert-butyl-4-methyl-1-{4-[(5-sulfamoyl-1,3,...)
Affinity DataKi:  11nM ΔG°:  -10.8kcal/molepH: 7.5 T: 2°CAssay Description:Initial rates of 4-nitrophenyl acetate hydrolysis catalyzed by different CA isozymes were monitored spectrophotometrically at 400 nm. A molar absorpt...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 9(Homo sapiens (Human))
Canadian Institutes Of Health Research

LigandPNGBDBM14721(2,6-di-tert-butyl-4-methyl-1-{4-[(5-sulfamoyl-1,3,...)
Affinity DataKi:  34nMAssay 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