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Target
Carbonic anhydrase 2
Ligand
BDBM50261581
Substrate
n/a
Meas. Tech.
ChEBML_1696140
IC50
202±n/a nM
Citation
 Ahmed, G; Elger, W; Meece, F; Nair, HB; Schneider, B; Wyrwa, R; Nickisch, K A prodrug design for improved oral absorption and reduced hepatic interaction. Bioorg Med Chem 25:5569-5575 (2017) [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:
BDBM50261581
Synonyms:
CHEMBL4086863
Type:
Small organic molecule
Emp. Form.:
C30H38N2O6S
Mol. Mass.:
554.698
SMILES:
[H][C@@]12CC[C@H](OC(=O)[C@@H](NC(=O)c3ccc(cc3)S(N)(=O)=O)C(C)C)[C@@]1(C)CC[C@]1([H])c3ccc(O)cc3CC[C@@]21[H] |r|
Structure:
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