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Target
Carbonic anhydrase 2
Ligand
BDBM50153964
Substrate
n/a
Meas. Tech.
ChEMBL_495458 (CHEMBL1005300)
Ki
84±n/a nM
Citation
 Thiry, A; Ledecq, M; Cecchi, A; Frederick, R; Dogné, JM; Supuran, CT; Wouters, J; Masereel, B Ligand-based and structure-based virtual screening to identify carbonic anhydrase IX inhibitors. Bioorg Med Chem 17:553-7 (2009) [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:
BDBM50153964
Synonyms:
4-((4,6-diethoxy-1,3,5-triazin-2-ylamino)methyl)benzenesulfonamide | 4-[(4,6-Diethoxy-[1,3,5]triazin-2-ylamino)-methyl]-benzenesulfonamide | CHEMBL183945
Type:
Small organic molecule
Emp. Form.:
C14H19N5O4S
Mol. Mass.:
353.397
SMILES:
CCOc1nc(NCc2ccc(cc2)S(N)(=O)=O)nc(OCC)n1
Structure:
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