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Target
Carbonic anhydrase 1
Ligand
BDBM50049514
Substrate
n/a
Meas. Tech.
ChEMBL_1450309 (CHEMBL3377546)
Ki
22±n/a nM
Citation
 Ceruso, M; Del Prete, S; AlOthman, Z; Osman, SM; Scozzafava, A; Capasso, C; Supuran, CT Synthesis of sulfonamides with effective inhibitory action against Porphyromonas gingivalis¿-carbonic anhydrase. Bioorg Med Chem Lett 24:4006-10 (2014) [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:
BDBM50049514
Synonyms:
CHEMBL3314183
Type:
Small organic molecule
Emp. Form.:
C15H23N3O5S
Mol. Mass.:
357.425
SMILES:
CC(C)(C)OC(=O)NCCCC(=O)Nc1cccc(c1)S(N)(=O)=O
Structure:
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