Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM50387117
Substrate
n/a
Meas. Tech.
ChEMBL_827863 (CHEMBL2051272)
Ki
413±n/a nM
Citation
 Winum, JY; Carta, F; Ward, C; Mullen, P; Harrison, D; Langdon, SP; Cecchi, A; Scozzafava, A; Kunkler, I; Supuran, CT Ureido-substituted sulfamates show potent carbonic anhydrase IX inhibitory and antiproliferative activities against breast cancer cell lines. Bioorg Med Chem Lett 22:4681-5 (2012) [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:
BDBM50387117
Synonyms:
4-ureidophenyl sulfamate ring derivative 3g | CHEMBL2047802
Type:
Small organic molecule
Emp. Form.:
C14H15N3O5S
Mol. Mass.:
337.351
SMILES:
COc1ccc(NC(=O)Nc2ccc(OS(N)(=O)=O)cc2)cc1
Structure:
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