BDBM171354 US9085571, Table 1, Compound 2

SMILES COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)C(=O)N(C)Cc1nc(C)co1

InChI Key InChIKey=KPIVTKIBGPQLAU-AJQTZOPKSA-N

Data  1 KI  1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 171354   

TargetProtease(Human immunodeficiency virus 1 (HIV-1))
Purdue Research Foundation

US Patent
LigandPNGBDBM171354(US9085571, Table 1, Compound 2)
Show SMILES COc1ccc(cc1)S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)C(=O)N(C)Cc1nc(C)co1
Show InChI InChI=1S/C35H42N4O7S/c1-24(2)20-39(47(43,44)30-16-14-29(45-5)15-17-30)21-32(40)31(18-26-10-7-6-8-11-26)37-34(41)27-12-9-13-28(19-27)35(42)38(4)22-33-36-25(3)23-46-33/h6-17,19,23-24,31-32,40H,18,20-22H2,1-5H3,(H,37,41)/t31-,32+/m0/s1
Affinity DataKi:  0.600nM IC50: 20nMAssay Description:Without being bound by theory, it is suggested that the compounds described herein may exert their utility by the inhibition of proteases encoded by ...More data for this Ligand-Target Pair