Reaction Details  Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM50046166
Substrate
n/a
Meas. Tech.
ChEMBL_1447567 (CHEMBL3373762)
IC50
8071±n/a nM
Citation
 Rosatelli, E; Carotti, A; Ceruso, M; Supuran, CT; Gioiello, A Flow synthesis and biological activity of aryl sulfonamides as selective carbonic anhydrase IX and XII inhibitors. Bioorg Med Chem Lett 24:3422-5 (2014) [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:
BDBM50046166
Synonyms:
CHEMBL3310984
Type:
Small organic molecule
Emp. Form.:
C12H19NO2S
Mol. Mass.:
241.35
SMILES:
CCCC(C)NS(=O)(=O)c1ccc(C)cc1
Structure:
Search PDB for entries with ligand similarity: