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Target
Carbonic anhydrase 3
Ligand
BDBM50329832
Substrate
n/a
Meas. Tech.
ChEMBL_1752585 (CHEMBL4187345)
Kd
750±n/a nM
Citation
 ?apkauskait?, E; Zak?auskas, A; Ruibys, V; Linkuvien?, V; Paketuryt?, V; Gedgaudas, M; Kairys, V; Matulis, D Benzimidazole design, synthesis, and docking to build selective carbonic anhydrase VA inhibitors. Bioorg Med Chem 26:675-687 (2018) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 3
Synonyms:
CA-III | CA3 | CAH3_HUMAN | Carbonate dehydratase III | Carbonic Anhydrase III | Carbonic anhydrase | Carbonic anhydrase 3 (CA III) | Carbonic anhydrase III (CA III)
Type:
Enzyme
Mol. Mass.:
29562.11
Organism:
Homo sapiens (Human)
Description:
Human cloned isozyme.
Residue:
260
Sequence:
MAKEWGYASHNGPDHWHELFPNAKGENQSPVELHTKDIRHDPSLQPWSVSYDGGSAKTILNNGKTCRVVFDDTYDRSMLRGGPLPGPYRLRQFHLHWGSSDDHGSEHTVDGVKYAAELHLVHWNPKYNTFKEALKQRDGIAVIGIFLKIGHENGEFQIFLDALDKIKTKGKEAPFTKFDPSCLFPACRDYWTYQGSFTTPPCEECIVWLLLKEPMTVSSDQMAKLRSLLSSAENEPPVPLVSNWRPPQPINNRVVRASFK
  
Inhibitor
Name:
BDBM50329832
Synonyms:
5-(1H-Benzimidazol-1-ylacetyl)-2-chlorobenzenesulfonamide | CHEMBL1272187 | N-alkylated benzimidazole derivative, 4a | carbonic anhydrase (CA) inhibitors, benzenesulphonamide ligand, 4
Type:
Small organic molecule
Emp. Form.:
C15H12ClN3O3S
Mol. Mass.:
349.792
SMILES:
NS(=O)(=O)c1cc(ccc1Cl)C(=O)Cn1cnc2ccccc12
Structure:
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