Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM50159796
Substrate
n/a
Meas. Tech.
ChEMBL_562666 (CHEMBL1011825)
Ki
6000±n/a nM
Citation
 Innocenti, A; Hall, RA; Schlicker, C; Mühlschlegel, FA; Supuran, CT Carbonic anhydrase inhibitors. Inhibition of the beta-class enzymes from the fungal pathogens Candida albicans and Cryptococcus neoformans with aliphatic and aromatic carboxylates. Bioorg Med Chem 17:2654-7 (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:
BDBM50159796
Synonyms:
2,3,5,6-F4-Benzoate | CHEMBL368444 | Sodium; 2,3,5,6-tetrafluoro-benzoate | sodium 2,3,5,6-tetrafluorobenzoate
Type:
Small organic molecule
Emp. Form.:
C7HF4O2
Mol. Mass.:
193.0758
SMILES:
[O-]C(=O)c1c(F)c(F)cc(F)c1F
Structure:
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