Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM50540749
Substrate
n/a
Meas. Tech.
ChEMBL_1982737 (CHEMBL4615999)
Ki
90±n/a nM
Citation
 Meleddu, R; Distinto, S; Cottiglia, F; Angius, R; Caboni, P; Angeli, A; Melis, C; Deplano, S; Alcaro, S; Ortuso, F; Supuran, CT; Maccioni, E New Dihydrothiazole Benzensulfonamides: Looking for Selectivity toward Carbonic Anhydrase Isoforms I, II, IX, and XII. ACS Med Chem Lett 11:852-856 (2020) [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:
BDBM50540749
Synonyms:
CHEMBL4643191
Type:
Small organic molecule
Emp. Form.:
C23H21N3O2S2
Mol. Mass.:
435.562
SMILES:
CCn1c(cs\c1=N\c1ccc(cc1)S(N)(=O)=O)-c1ccc(cc1)-c1ccccc1
Structure:
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