Compile Data Set for Download or QSAR
Found 1 Enz. Inhib. hit(s) with Target = 'Protease' and Ligand = 'BDBM50498811'
TargetProtease(Human immunodeficiency virus 1 (HIV-1))
Purdue University

Curated by ChEMBL
LigandPNGBDBM50498811(CHEMBL3627851)
Show SMILES CCCNC(=O)c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN(CC(C)C)S(=O)(=O)c1ccc(OC)cc1
Show InChI InChI=1S/C32H41N3O6S/c1-5-18-33-31(37)25-12-9-13-26(20-25)32(38)34-29(19-24-10-7-6-8-11-24)30(36)22-35(21-23(2)3)42(39,40)28-16-14-27(41-4)15-17-28/h6-17,20,23,29-30,36H,5,18-19,21-22H2,1-4H3,(H,33,37)(H,34,38)/t29-,30+/m0/s1
Affinity DataKi:  25nMAssay Description:Inhibition of HIV-1 protease by fluorometric assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid