Compile Data Set for Download or QSAR
Found 1 Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9' and Ligand = 'BDBM50028011'
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
King Saud University

Curated by ChEMBL
LigandPNGBDBM50028011(CHEMBL3360810)
Show SMILES Cc1c(sc2sc(c(-c3ccccc3)c12)-c1ccc(C#N)c(=O)[nH]1)-c1ccc(C(O)=O)c(=O)[nH]1
Show InChI InChI=1S/C25H15N3O4S2/c1-12-18-19(13-5-3-2-4-6-13)21(17-9-7-14(11-26)22(29)27-17)34-25(18)33-20(12)16-10-8-15(24(31)32)23(30)28-16/h2-10H,1H3,(H,27,29)(H,28,30)(H,31,32)
Affinity DataIC50: 2.70E+5nMAssay Description:Inhibition of carbonic anhydrase (unknown origin)More data for this Ligand-Target Pair