Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Genome polyprotein' and Ligand = 'BDBM307559'   

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
Genome polyprotein (Hepatitis C virus (HCV))	BDBM307559 (5-(3-((2-(1,2,4-oxadiazol-3-yl)propan-2-yl)carbamo...) Show SMILES CNC(=O)c1c(oc2cc(OCC(C)C)c(cc12)-c1ccc(OC)c(c1)C(=O)NC(C)(C)c1ncon1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H33FN4O6/c1-18(2)16-42-26-15-27-23(28(31(40)35-5)29(44-27)19-7-10-21(34)11-8-19)14-22(26)20-9-12-25(41-6)24(13-20)30(39)37-33(3,4)32-36-17-43-38-32/h7-15,17-18H,16H2,1-6H3,(H,35,40)(H,37,39)	PDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description To evaluate compound efficacy, titrated compounds were transferred to sterile 384-well tissue culture treated plates, and the plates were seeded with...				US Patent US10150747 (2018) BindingDB Entry DOI: 10.7270/Q2H70HWJ
					More data for this Ligand-Target Pair
Genome polyprotein (Hepatitis C virus (HCV))	BDBM307559 (5-(3-((2-(1,2,4-oxadiazol-3-yl)propan-2-yl)carbamo...) Show SMILES CNC(=O)c1c(oc2cc(OCC(C)C)c(cc12)-c1ccc(OC)c(c1)C(=O)NC(C)(C)c1ncon1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H33FN4O6/c1-18(2)16-42-26-15-27-23(28(31(40)35-5)29(44-27)19-7-10-21(34)11-8-19)14-22(26)20-9-12-25(41-6)24(13-20)30(39)37-33(3,4)32-36-17-43-38-32/h7-15,17-18H,16H2,1-6H3,(H,35,40)(H,37,39)	PDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	80	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company US Patent					Assay Description To evaluate compound efficacy, titrated compounds were transferred to sterile 384-well tissue culture treated plates, and the plates were seeded with...				US Patent US10150747 (2018) BindingDB Entry DOI: 10.7270/Q2H70HWJ
					More data for this Ligand-Target Pair