Reaction Details Report a problem with these data
Target
Carbonic anhydrase
Ligand
BDBM50031472
Substrate
n/a
Meas. Tech.
ChEMBL_757508 (CHEMBL1804480)
Ki
4390±n/a nM
Citation
 Oztürk Sarikaya, SB; Topal, F; Sentürk, M; Gülçin, I; Supuran, CT In vitro inhibition ofa-carbonic anhydrase isozymes by some phenolic compounds. Bioorg Med Chem Lett 21:4259-62 (2011) [PubMed]  Article 
Target
Name:
Carbonic anhydrase
Synonyms:
n/a
Type:
PROTEIN
Mol. Mass.:
32973.15
Organism:
Dicentrarchus labrax
Description:
ChEMBL_757508
Residue:
309
Sequence:
MNWLVAALAVCVLVPSANCASDSVAWCYHQPSCNDTTWPTIAAKYCNGTRQSPINIVSASAEPNANLTEFTFQNYGDTSILKKILNTGKTVQVSLGSGVSISGGDLSEAYDSLQFHLHWGKGSSIPGSDGKRYPMELHIVNSKSTFNGNTTLAVKDSTGLAALGFFIEETSGNETQQPASWNTLTSYLANITNSGDSVSIAPGISLDDLLVGVDRTKYYRYLGSLTTPQLQEAVVWTVFKDSIKVSKDLIDLFSTTVHVSNTSSPLMTNVFRNVQPAQPVTTQAASSSATSKTCYSLGLMALSLALGRS
  
Inhibitor
Name:
BDBM50031472
Synonyms:
1,2,3-Trihydroxybenzene, XIV | CHEMBL307145 | Pyrogallol (10) | benzene-1,2,3-triol | pyrogallol
Type:
Small organic molecule
Emp. Form.:
C6H6O3
Mol. Mass.:
126.11
SMILES:
Oc1cccc(O)c1O
Structure:
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