Reaction Details Report a problem with these data
Target
Carbonic anhydrase 3
Ligand
BDBM50187132
Substrate
n/a
Meas. Tech.
ChEMBL_613330 (CHEMBL1074267)
Ki
8580±n/a nM
Citation
 Innocenti, A; Beyza Oztürk Sarikaya, S; Gülçin, I; Supuran, CT Carbonic anhydrase inhibitors. Inhibition of mammalian isoforms I-XIV with a series of natural product polyphenols and phenolic acids. Bioorg Med Chem 18:2159-64 (2010) [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:
BDBM50187132
Synonyms:
3,5-Dimethoxy-4-hydroxybenzoic acid | 4-hydroxy-3,5-dimethoxybenzoic acid | CHEMBL1414 | Syringic acid
Type:
Small organic molecule
Emp. Form.:
C9H10O5
Mol. Mass.:
198.1727
SMILES:
COc1cc(cc(OC)c1O)C(O)=O
Structure:
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