Reaction Details Report a problem with these data
Target
Carbonic anhydrase 1
Ligand
BDBM50308986
Substrate
n/a
Meas. Tech.
Esterase Activity Assay
pH
7.4±n/a
IC50
1.3e+2±n/a nM
Comments
extracted
Citation
 Yenikaya, C; Sari, M; Bülbül, M; Ilkimen, H; Cinar, B; Büyükgüngör, O Synthesis and characterisation of two novel proton transfer compounds and their inhibition studies on carbonic anhydrase isoenzymes. J Enzyme Inhib Med Chem 26:104-14 (2011) [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:
BDBM50308986
Synonyms:
2,4-Dichloro-5-sulphamoylbenzoate (2) | CHEMBL590825 | pyridin-2-ylmethanaminium 2,4-dichloro-5-sulfamoylbenzoate
Type:
Small organic molecule
Emp. Form.:
C7H4Cl2NO4S
Mol. Mass.:
269.083
SMILES:
NS(=O)(=O)c1cc(C([O-])=O)c(Cl)cc1Cl
Structure:
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