Reaction Details Report a problem with these data
Target
Carbonic anhydrase 1
Ligand
BDBM50321258
Substrate
n/a
Meas. Tech.
CO2 Hydration Assay
pH
7.5±n/a
Temperature
298.15±n/a K
Ki
316±n/a nM
Comments
extracted
Citation
 Alp, C; Maresca, A; Alp, NA; Gültekin, MS; Ekinci, D; Scozzafava, A; Supuran, CT Secondary/tertiary benzenesulfonamides with inhibitory action against the cytosolic human carbonic anhydrase isoforms I and II. J Enzyme Inhib Med Chem 28:294-8 (2013) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 1
Synonyms:
CA-I | CA1 | CAB | CAH1_HUMAN | Carbonate dehydratase I | Carbonic anhydrase | Carbonic anhydrase 1 (CA I) | Carbonic anhydrase 1 (CA-I) | Carbonic anhydrase 1 (Recombinant CA I) | Carbonic anhydrase 2 (CA II) | Carbonic anhydrase B | Carbonic anhydrase I | Carbonic anhydrase I (CA I) | Carbonic anhydrase I (CA-I) | Carbonic anhydrase I (CAI) | Carbonic anhydrase I (hCA I) | Carbonic anhydrase isoenzyme I (hCA I) | hCA
Type:
Enzyme
Mol. Mass.:
28873.37
Organism:
Homo sapiens (Human)
Description:
P00915
Residue:
261
Sequence:
MASPDWGYDDKNGPEQWSKLYPIANGNNQSPVDIKTSETKHDTSLKPISVSYNPATAKEIINVGHSFHVNFEDNDNRSVLKGGPFSDSYRLFQFHFHWGSTNEHGSEHTVDGVKYSAELHVAHWNSAKYSSLAEAASKADGLAVIGVLMKVGEANPKLQKVLDALQAIKTKGKRAPFTNFDPSTLLPSSLDFWTYPGSLTHPPLYESVTWIICKESISVSSEQLAQFRSLLSNVEGDNAVPMQHNNRPTQPLKGRTVRASF
  
Inhibitor
Name:
BDBM50321258
Synonyms:
5-oxo-1-tosyl-2,5-dihydro-1Hpyrrol-2-yl acetate | CA inhibitor, 17 | CHEMBL1164744
Type:
Small organic molecule
Emp. Form.:
C13H13NO5S
Mol. Mass.:
295.311
SMILES:
CC(=O)OC1C=CC(=O)N1S(=O)(=O)c1ccc(C)cc1 |c:5|
Structure:
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