Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM50175052
Substrate
n/a
Meas. Tech.
ChEMBL_326924 (CHEMBL854316)
Ki
4.7±n/a nM
Citation
 Poulsen, SA; Bornaghi, LF; Healy, PC Synthesis and structure-activity relationships of novel benzene sulfonamides with potent binding affinity for bovine carbonic anhydrase II. Bioorg Med Chem Lett 15:5429-33 (2005) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 2
Synonyms:
CA2 | CAH2_BOVIN | Carbonic anhydrase | Carbonic anhydrase 2 | Carbonic anhydrase II | Carbonic anhydrase II (CA II) | Carbonic anhydrase II (CA-II)
Type:
Enzyme Catalytic Domain
Mol. Mass.:
29115.93
Organism:
Bos taurus
Description:
n/a
Residue:
260
Sequence:
MSHHWGYGKHNGPEHWHKDFPIANGERQSPVDIDTKAVVQDPALKPLALVYGEATSRRMVNNGHSFNVEYDDSQDKAVLKDGPLTGTYRLVQFHFHWGSSDDQGSEHTVDRKKYAAELHLVHWNTKYGDFGTAAQQPDGLAVVGVFLKVGDANPALQKVLDALDSIKTKGKSTDFPNFDPGSLLPNVLDYWTYPGSLTTPPLLESVTWIVLKEPISVSSQQMLKFRTLNFNAEGEPELLMLANWRPAQPLKNRQVRGFPK
  
Inhibitor
Name:
BDBM50175052
Synonyms:
(2E)-(4-benzoyloxy)but-2-enyl-4-(aminosulfonyl)benzoate | CHEMBL200931
Type:
Small organic molecule
Emp. Form.:
C18H17NO6S
Mol. Mass.:
375.396
SMILES:
NS(=O)(=O)c1ccc(cc1)C(=O)OC\C=C\COC(=O)c1ccccc1
Structure:
Search PDB for entries with ligand similarity: