Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM50068112
Substrate
n/a
Meas. Tech.
ChEMBL_1464059 (CHEMBL3406244)
Ki
112±n/a nM
Citation
 Yildirim, A; Atmaca, U; Keskin, A; Topal, M; Çelik, M; Gülçin, I; Supuran, CT N-Acylsulfonamides strongly inhibit human carbonic anhydrase isoenzymes I and II. Bioorg Med Chem 23:2598-605 (2015) [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:
BDBM50068112
Synonyms:
CHEMBL3402245
Type:
Small organic molecule
Emp. Form.:
C23H23NO5S
Mol. Mass.:
425.497
SMILES:
[H][C@@]12C[C@@]([H])(C=C1)[C@H](C2C(=O)NS(=O)(=O)c1ccc(C)cc1)C(=O)OCc1ccccc1 |r,c:5|
Structure:
Search PDB for entries with ligand similarity: