Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM50049465
Substrate
n/a
Meas. Tech.
ChEMBL_1453971 (CHEMBL3366665)
Ki
76±n/a nM
Citation
 Ceruso, M; Del Prete, S; Alothman, Z; Capasso, C; Supuran, CT Sulfonamides with Potent Inhibitory Action and Selectivity against thea-Carbonic Anhydrase from Vibrio cholerae. ACS Med Chem Lett 5:826-30 (2014) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 2
Synonyms:
CA-II | CA2 | CAC | CAH2_HUMAN | Carbonate dehydratase II | Carbonic anhydrase 2 (CA II) | Carbonic anhydrase 2 (CA-II) | Carbonic anhydrase 2 (Recombinant CA II) | Carbonic anhydrase C | Carbonic anhydrase II (CA II) | Carbonic anhydrase II (CA-II) | Carbonic anhydrase II (CAII) | Carbonic anhydrase II (hCA II) | Carbonic anhydrase isoenzyme II (hCA II)
Type:
Enzyme
Mol. Mass.:
29250.71
Organism:
Homo sapiens (Human)
Description:
P00918
Residue:
260
Sequence:
MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRILNNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHLVHWNTKYGDFGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDPRGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELMVDNWRPAQPLKNRQIKASFK
  
Inhibitor
Name:
BDBM50049465
Synonyms:
CHEMBL3314176
Type:
Small organic molecule
Emp. Form.:
C21H34N4O6S
Mol. Mass.:
470.583
SMILES:
CC(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)NCCc1ccc(cc1)S(N)(=O)=O
Structure:
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