Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gag-Pol polyprotein [588-1147,M628L,T656S,M771V,L797W,T802Y]' and Ligand = 'BDBM77145'   

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 [588-1147,M628L,T656S,M771V,L797W,T802Y] (Human immunodeficiency virus type 1 group M subtyp...)	BDBM77145 (9-((R)-2-((Bis(((isopropoxycarbonyl)oxy)methoxy)ph...) Show SMILES CC(C)OC(=O)OCOP(=O)(CO[C@H](C)Cn1cnc2c(N)ncnc12)OCOC(=O)OC(C)C Show InChI InChI=1S/C19H30N5O10P/c1-12(2)33-18(25)28-9-31-35(27,32-10-29-19(26)34-13(3)4)11-30-14(5)6-24-8-23-15-16(20)21-7-22-17(15)24/h7-8,12-14H,6,9-11H2,1-5H3,(H2,20,21,22)/t14-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	US Patent	n/a	n/a	>6.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chimerix, Inc. US Patent					Assay Description The PhenoSense report form includes drug resistance information for all of the approved nucleoside reverse transcriptase inhibitors (NRTIs), nonnucle...				US Patent US9694024 (2017) BindingDB Entry DOI: 10.7270/Q2BV7DRT
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