Target
Carbonic anhydrase 2
Ligand
BDBM50261571
Substrate
n/a
Meas. Tech.
ChEMBL_531442 (CHEMBL967623)
Ki
470±n/a nM
Citation
 Thiry, ASupuran, CTMasereel, BDogné, JM Recent developments of carbonic anhydrase inhibitors as potential anticancer drugs. J Med Chem 51:3051-6 (2008) [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:
BDBM50261571
Synonyms:
Acetic acid (2R,3R,4S,5R,6S)-3,4,5-triacetoxy-6-{4-[(4-sulfamoyl-benzoylamino)-methyl]-[1,2,3]triazol-1-yloxy}-tetrahydro-pyran-2-ylmethyl ester | CHEMBL505415
Type:
Small organic molecule
Emp. Form.:
C24H29N5O13S
Mol. Mass.:
627.578
SMILES:
CC(=O)OC[C@H]1O[C@@H](On2cc(CNC(=O)c3ccc(cc3)S(N)(=O)=O)nn2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O |r|
Structure:
Search PDB for entries with ligand similarity: