Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM50326674
Substrate
n/a
Meas. Tech.
ChEMBL_662065 (CHEMBL1251875)
Ki
4.5±n/a nM
Citation
 Marques, SM; Enyedy, EA; Supuran, CT; Krupenko, NI; Krupenko, SA; Santos, MA Pteridine-sulfonamide conjugates as dual inhibitors of carbonic anhydrases and dihydrofolate reductase with potential antitumor activity. Bioorg Med Chem 18:5081-9 (2010) [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:
BDBM50326674
Synonyms:
4-((2,4-Diaminopteridin-6-yl)methylamino)benzenesulfonamide | CHEMBL1254767
Type:
Small organic molecule
Emp. Form.:
C13H14N8O2S
Mol. Mass.:
346.368
SMILES:
Nc1nc(N)c2nc(CNc3ccc(cc3)S(N)(=O)=O)cnc2n1
Structure:
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