Reaction Details Report a problem with these data
Target
Carbonic anhydrase
Ligand
BDBM50387133
Substrate
n/a
Meas. Tech.
ChEMBL_955915 (CHEMBL2379884)
Ki
1431±n/a nM
Citation
 Vullo, D; Leewattanapasuk, W; Mühlschlegel, FA; Mastrolorenzo, A; Capasso, C; Supuran, CT Carbonic anhydrase inhibitors: inhibition of the฿-class enzyme from the pathogenic yeast Candida glabrata with sulfonamides, sulfamates and sulfamides. Bioorg Med Chem Lett 23:2647-52 (2013) [PubMed]  Article 
Target
Name:
Carbonic anhydrase
Synonyms:
CAN_CANAL | NCE103 | beta-Carbonic Anhydrase
Type:
Enzyme
Mol. Mass.:
31587.59
Organism:
Candida albicans (Yeast)
Description:
n/a
Residue:
281
Sequence:
MGRENILKYQLEHDHESDLVTEKDQSLLLDNNNNLNGMNNTIKTHPVRVSSGNHNNFPFTLSSESTLQDFLNNNKFFVDSIKHNHGNQIFDLNGQGQSPHTLWIGCSDSRAGDQCLATLPGEIFVHRNIANIVNANDISSQGVIQFAIDVLKVKKIIVCGHTDCGGIWASLSKKKIGGVLDLWLNPVRHIRAANLKLLEEYNQDPKLKAKKLAELNVISSVTALKRHPSASVALKKNEIEVWGMLYDVATGYLSQVEIPQDEFEDLFHVHDEHDEEEYNPH
  
Inhibitor
Name:
BDBM50387133
Synonyms:
CHEMBL2047813
Type:
Small organic molecule
Emp. Form.:
C17H15N3O4S
Mol. Mass.:
357.384
SMILES:
NS(=O)(=O)Oc1ccc(NC(=O)Nc2cccc3ccccc23)cc1
Structure:
Search PDB for entries with ligand similarity: