Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM50517102
Substrate
n/a
Meas. Tech.
ChEMBL_1867349 (CHEMBL4368324)
Ki
0.540000±n/a nM
Citation
 Kalinin, S; Valtari, A; Ruponen, M; Toropainen, E; Kovalenko, A; Nocentini, A; Gureev, M; Dar'in, D; Urtti, A; Supuran, CT; Krasavin, M Highly hydrophilic 1,3-oxazol-5-yl benzenesulfonamide inhibitors of carbonic anhydrase II for reduction of glaucoma-related intraocular pressure. Bioorg Med Chem 27:0 (2019) [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:
Human
Description:
P00918
Residue:
260
Sequence:
MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRILNNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHLVHWNTKYGDFGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDPRGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELMVDNWRPAQPLKNRQIKASFK
  
Inhibitor
Name:
BDBM50517102
Synonyms:
CHEMBL4541944
Type:
Small organic molecule
Emp. Form.:
C15H18N4O4S
Mol. Mass.:
350.393
SMILES:
NC1CCN(CC1)C(=O)c1ncc(o1)-c1ccc(cc1)S(N)(=O)=O
Structure:
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