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Target
Carbonic anhydrase 1
Ligand
BDBM50562194
Substrate
n/a
Meas. Tech.
ChEMBL_2077674 (CHEMBL4733465)
Ki
870±n/a nM
Citation
 Bouzina, A; Berredjem, M; Nocentini, A; Bua, S; Bouaziz, Z; Jose, J; Le Borgne, M; Marminon, C; Gratteri, P; Supuran, CT Ninhydrins inhibit carbonic anhydrases directly binding to the metal ion. Eur J Med Chem 209:0 (2021) [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:
BDBM50562194
Synonyms:
CHEMBL4798972
Type:
Small organic molecule
Emp. Form.:
C10H8O5
Mol. Mass.:
208.1675
SMILES:
COc1cccc2C(=O)C(O)(O)C(=O)c12
Structure:
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