Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM75364
Substrate
n/a
Meas. Tech.
ChEMBL_1513115 (CHEMBL3610543)
Ki
6.5±n/a nM
Citation
 Congiu, C; Onnis, V; Deplano, A; Balboni, G; Dedeoglu, N; Supuran, CT Synthesis of sulfonamides incorporating piperazinyl-ureido moieties and their carbonic anhydrase I, II, IX and XII inhibitory activity. Bioorg Med Chem Lett 25:3850-3 (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:
BDBM75364
Synonyms:
4-(phenylmethyl)-N-(4-sulfamoylphenyl)-1-piperazinecarboxamide | 4-(phenylmethyl)-N-(4-sulfamoylphenyl)piperazine-1-carboxamide | 4-benzyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide | MLS-0435629.0001 | cid_27869236
Type:
Small organic molecule
Emp. Form.:
C18H22N4O3S
Mol. Mass.:
374.457
SMILES:
NS(=O)(=O)c1ccc(NC(=O)N2CCN(Cc3ccccc3)CC2)cc1
Structure:
Search PDB for entries with ligand similarity: