Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gag-Pol polyprotein' and Ligand = 'BDBM192672'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Gag-Pol polyprotein (Human immunodeficiency virus type 1 group M subtyp...)	BDBM192672 (3-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)-1-(4-(2...) Show SMILES COc1ccc2N(CCC(=O)N3CCN(CC3)c3ccccc3OC)CCCc2c1 Show InChI InChI=1S/C24H31N3O3/c1-29-20-9-10-21-19(18-20)6-5-12-25(21)13-11-24(28)27-16-14-26(15-17-27)22-7-3-4-8-23(22)30-2/h3-4,7-10,18H,5-6,11-17H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.28E+4	n/a	n/a	n/a	n/a	n/a	n/a
Birla Institute of Technology & Science					Assay Description The reaction mixture was set with template primer complex, RT enzyme and dNTPs in a lysis buffer with or without inhibitors. The reaction mixture was...				Bioorg Chem 67: 75-83 (2016) Article DOI: 10.1016/j.bioorg.2016.05.009 BindingDB Entry DOI: 10.7270/Q2VT1QWC
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