Compile Data Set for Download or QSAR

Found 67 hits of ic50 for UniProtKB: P27958   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235836 (US9364482, 10) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(Cc3ccc(Cl)cc3)C(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H26ClFN4O6S/c1-35-31(39)28-23-14-22(25(37(2)45(3,41)42)15-27(23)44-30(28)19-6-10-21(34)11-7-19)24-12-13-26-29(36-24)32(40)38(17-43-26)16-18-4-8-20(33)9-5-18/h4-15H,16-17H2,1-3H3,(H,35,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.768	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235856 (US9364482, 30) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(C(C)c3ccc(F)cc3)C(=O)c2n1)-c1ccc(F)cc1 |@@:25| Show InChI InChI=1S/C33H28F2N4O6S/c1-18(19-5-9-21(34)10-6-19)39-17-44-27-14-13-25(37-30(27)33(39)41)23-15-24-28(16-26(23)38(3)46(4,42)43)45-31(29(24)32(40)36-2)20-7-11-22(35)12-8-20/h5-16,18H,17H2,1-4H3,(H,36,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.981	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235861 (US9364482, 36) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2CCN(Cc3ccc(F)cc3)C(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H28F2N4O5S/c1-36-32(40)29-25-16-24(27(38(2)45(3,42)43)17-28(25)44-31(29)21-6-11-23(35)12-7-21)26-13-8-20-14-15-39(33(41)30(20)37-26)18-19-4-9-22(34)10-5-19/h4-13,16-17H,14-15,18H2,1-3H3,(H,36,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.08	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235863 (US9364482, 38) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2ccn(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C34H27F2N3O5S/c1-37-33(40)31-28-17-26(29(38(2)45(3,42)43)18-30(28)44-32(31)22-8-12-25(36)13-9-22)23-7-6-21-14-15-39(34(41)27(21)16-23)19-20-4-10-24(35)11-5-20/h4-18H,19H2,1-3H3,(H,37,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.38	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235833 (US9364482, 7) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(Cc3cccc(F)c3)C(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H26F2N4O6S/c1-35-31(39)28-23-14-22(25(37(2)45(3,41)42)15-27(23)44-30(28)19-7-9-20(33)10-8-19)24-11-12-26-29(36-24)32(40)38(17-43-26)16-18-5-4-6-21(34)13-18/h4-15H,16-17H2,1-3H3,(H,35,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.48	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235845 (US9364482, 19) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cnc2NCN(Cc3ccc(F)cc3)C(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H27F2N5O5S/c1-35-31(40)28-24-13-23(26(38(2)45(3,42)43)14-27(24)44-29(28)19-6-10-22(34)11-7-19)20-12-25-30(36-15-20)37-17-39(32(25)41)16-18-4-8-21(33)9-5-18/h4-15H,16-17H2,1-3H3,(H,35,40)(H,36,37)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.60	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235880 (US9364482, 55) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C34H28F2N4O5S/c1-19-38-28-14-9-22(15-26(28)34(42)40(19)18-20-5-10-23(35)11-6-20)25-16-27-30(17-29(25)39(3)46(4,43)44)45-32(31(27)33(41)37-2)21-7-12-24(36)13-8-21/h5-17H,18H2,1-4H3,(H,37,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.93	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235887 (US9364482, 68) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n(Cc3ccc(F)cc3)c(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H27F2N5O5S/c1-18-37-26-14-13-25(38-30(26)33(42)40(18)17-19-5-9-21(34)10-6-19)23-15-24-28(16-27(23)39(3)46(4,43)44)45-31(29(24)32(41)36-2)20-7-11-22(35)12-8-20/h5-16H,17H2,1-4H3,(H,36,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.00	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235860 (US9364482, 35) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2CCN(Cc3ccc(F)cc3)C(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C34H29F2N3O5S/c1-37-33(40)31-28-17-26(29(38(2)45(3,42)43)18-30(28)44-32(31)22-8-12-25(36)13-9-22)23-7-6-21-14-15-39(34(41)27(21)16-23)19-20-4-10-24(35)11-5-20/h4-13,16-18H,14-15,19H2,1-3H3,(H,37,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.15	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235879 (US9364482, 54) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(CNC(C)=O)n(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C36H31F2N5O6S/c1-20(44)40-18-32-41-29-14-9-23(15-27(29)36(46)43(32)19-21-5-10-24(37)11-6-21)26-16-28-31(17-30(26)42(3)50(4,47)48)49-34(33(28)35(45)39-2)22-7-12-25(38)13-8-22/h5-17H,18-19H2,1-4H3,(H,39,45)(H,40,44)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.34	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235839 (US9364482, 13) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cnc2OCN(Cc3ccc(F)cc3)C(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H26F2N4O6S/c1-35-30(39)28-24-13-23(26(37(2)45(3,41)42)14-27(24)44-29(28)19-6-10-22(34)11-7-19)20-12-25-31(36-15-20)43-17-38(32(25)40)16-18-4-8-21(33)9-5-18/h4-15H,16-17H2,1-3H3,(H,35,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.55	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235878 (US9364482, 53) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(COC)n(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C35H30F2N4O6S/c1-38-34(42)32-27-16-25(29(40(2)48(4,44)45)17-30(27)47-33(32)21-7-12-24(37)13-8-21)22-9-14-28-26(15-22)35(43)41(31(39-28)19-46-3)18-20-5-10-23(36)11-6-20/h5-17H,18-19H2,1-4H3,(H,38,42)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.57	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235850 (US9364482, 24) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cnc2ncn(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H25F2N5O5S/c1-35-31(40)28-24-13-23(26(38(2)45(3,42)43)14-27(24)44-29(28)19-6-10-22(34)11-7-19)20-12-25-30(36-15-20)37-17-39(32(25)41)16-18-4-8-21(33)9-5-18/h4-15,17H,16H2,1-3H3,(H,35,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.59	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235832 (US9364482, 6) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(Cc3ccc(F)cc3)C(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H26F2N4O6S/c1-35-31(39)28-23-14-22(25(37(2)45(3,41)42)15-27(23)44-30(28)19-6-10-21(34)11-7-19)24-12-13-26-29(36-24)32(40)38(17-43-26)16-18-4-8-20(33)9-5-18/h4-15H,16-17H2,1-3H3,(H,35,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.78	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235831 (US9364482, 5) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(Cc3ccc(OC)cc3)C(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H29FN4O7S/c1-35-32(39)29-24-15-23(26(37(2)46(4,41)42)16-28(24)45-31(29)20-7-9-21(34)10-8-20)25-13-14-27-30(36-25)33(40)38(18-44-27)17-19-5-11-22(43-3)12-6-19/h5-16H,17-18H2,1-4H3,(H,35,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.06	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235875 (US9364482, 50) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2ncn([C@H](C)c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C34H28F2N4O5S/c1-19(20-5-10-23(35)11-6-20)40-18-38-28-14-9-22(15-26(28)34(40)42)25-16-27-30(17-29(25)39(3)46(4,43)44)45-32(31(27)33(41)37-2)21-7-12-24(36)13-8-21/h5-19H,1-4H3,(H,37,41)/t19-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.18	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235827 (US9364482, 1) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(Cc3ccccc3)C(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H27FN4O6S/c1-34-31(38)28-23-15-22(24-13-14-26-29(35-24)32(39)37(18-42-26)17-19-7-5-4-6-8-19)25(36(2)44(3,40)41)16-27(23)43-30(28)20-9-11-21(33)12-10-20/h4-16H,17-18H2,1-3H3,(H,34,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.22	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235890 (US9364482, 71) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc(OC)c2nnn(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H27F2N5O6S/c1-36-32(41)29-24-15-23(26(39(2)47(4,43)44)16-27(24)46-31(29)19-7-11-22(35)12-8-19)20-13-25-30(28(14-20)45-3)37-38-40(33(25)42)17-18-5-9-21(34)10-6-18/h5-16H,17H2,1-4H3,(H,36,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.49	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235849 (US9364482, 23) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cnc2ncn(-c3cccc(F)c3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C31H23F2N5O5S/c1-34-30(39)27-23-13-22(18-11-24-29(35-15-18)36-16-38(31(24)40)21-6-4-5-20(33)12-21)25(37(2)44(3,41)42)14-26(23)43-28(27)17-7-9-19(32)10-8-17/h4-16H,1-3H3,(H,34,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.98	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235864 (US9364482, 39) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn([C@H](COC)c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C34H29F2N5O6S/c1-37-33(42)31-26-16-24(28(40(2)48(4,44)45)17-30(26)47-32(31)20-7-12-23(36)13-8-20)21-9-14-27-25(15-21)34(43)41(39-38-27)29(18-46-3)19-5-10-22(35)11-6-19/h5-17,29H,18H2,1-4H3,(H,37,42)/t29-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.04	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235883 (US9364482, 64) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n(Cc3ccc(F)cc3F)c(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H26F3N5O5S/c1-17-38-26-12-11-25(39-30(26)33(43)41(17)16-19-7-10-21(35)13-24(19)36)22-14-23-28(15-27(22)40(3)47(4,44)45)46-31(29(23)32(42)37-2)18-5-8-20(34)9-6-18/h5-15H,16H2,1-4H3,(H,37,42)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.12	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235829 (US9364482, 3) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(C(=O)c2n1)c1cccc(F)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C31H24F2N4O6S/c1-34-30(38)27-22-14-21(23-11-12-25-28(35-23)31(39)37(16-42-25)20-6-4-5-19(33)13-20)24(36(2)44(3,40)41)15-26(22)43-29(27)17-7-9-18(32)10-8-17/h4-15H,16H2,1-3H3,(H,34,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.83	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235846 (US9364482, 20) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2ncn(-c3ccccc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H25FN4O5S/c1-34-31(38)29-25-16-23(20-11-14-26-24(15-20)32(39)37(18-35-26)22-7-5-4-6-8-22)27(36(2)43(3,40)41)17-28(25)42-30(29)19-9-12-21(33)13-10-19/h4-18H,1-3H3,(H,34,38)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.94	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235854 (US9364482, 28) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cnc2ncn(-c3cccc(F)c3)c(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C30H22F2N6O5S/c1-33-29(39)25-21-12-20(22-14-34-28-26(36-22)30(40)38(15-35-28)19-6-4-5-18(32)11-19)23(37(2)44(3,41)42)13-24(21)43-27(25)16-7-9-17(31)10-8-16/h4-15H,1-3H3,(H,33,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.96	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235886 (US9364482, 67) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n([C@H](COC)c3ccc(F)cc3)c(=O)c2n1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C35H31F2N5O6S/c1-19-39-27-15-14-26(40-32(27)35(44)42(19)29(18-47-4)20-6-10-22(36)11-7-20)24-16-25-30(17-28(24)41(3)49(5,45)46)48-33(31(25)34(43)38-2)21-8-12-23(37)13-9-21/h6-17,29H,18H2,1-5H3,(H,38,43)/t29-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.97	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235869 (US9364482, 44) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H25F2N5O5S/c1-35-31(40)29-25-15-23(27(38(2)45(3,42)43)16-28(25)44-30(29)19-6-11-22(34)12-7-19)20-8-13-26-24(14-20)32(41)39(37-36-26)17-18-4-9-21(33)10-5-18/h4-16H,17H2,1-3H3,(H,35,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.62	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235834 (US9364482, 8) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(Cc3ccccc3F)C(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H26F2N4O6S/c1-35-31(39)28-22-14-21(25(37(2)45(3,41)42)15-27(22)44-30(28)18-8-10-20(33)11-9-18)24-12-13-26-29(36-24)32(40)38(17-43-26)16-19-6-4-5-7-23(19)34/h4-15H,16-17H2,1-3H3,(H,35,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.87	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235865 (US9364482, 40) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn([C@H](CO)c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C33H27F2N5O6S/c1-36-32(42)30-25-15-23(27(39(2)47(3,44)45)16-29(25)46-31(30)19-6-11-22(35)12-7-19)20-8-13-26-24(14-20)33(43)40(38-37-26)28(17-41)18-4-9-21(34)10-5-18/h4-16,28,41H,17H2,1-3H3,(H,36,42)/t28-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.19	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235874 (US9364482, 49) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2ncn(Cc3ccccc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H27FN4O5S/c1-35-32(39)30-26-16-24(22-11-14-27-25(15-22)33(40)38(19-36-27)18-20-7-5-4-6-8-20)28(37(2)44(3,41)42)17-29(26)43-31(30)21-9-12-23(34)13-10-21/h4-17,19H,18H2,1-3H3,(H,35,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.25	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235847 (US9364482, 21) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cnc2ncn(-c3ccccc3F)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C31H23F2N5O5S/c1-34-30(39)27-21-13-20(18-12-22-29(35-15-18)36-16-38(31(22)40)24-7-5-4-6-23(24)33)25(37(2)44(3,41)42)14-26(21)43-28(27)17-8-10-19(32)11-9-17/h4-16H,1-3H3,(H,34,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.32	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235877 (US9364482, 52) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2ncn(Cc3ccc(F)cn3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H25F2N5O5S/c1-35-31(40)29-25-13-23(27(38(2)45(3,42)43)14-28(25)44-30(29)18-4-7-20(33)8-5-18)19-6-11-26-24(12-19)32(41)39(17-37-26)16-22-10-9-21(34)15-36-22/h4-15,17H,16H2,1-3H3,(H,35,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.37	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235888 (US9364482, 69) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc(OC)c2nc(C)n(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C35H30F2N4O6S/c1-19-39-32-27(35(43)41(19)18-20-6-10-23(36)11-7-20)14-22(15-30(32)46-4)25-16-26-29(17-28(25)40(3)48(5,44)45)47-33(31(26)34(42)38-2)21-8-12-24(37)13-9-21/h6-17H,18H2,1-5H3,(H,38,42)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.64	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235873 (US9364482, 48) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn(Cc3ccc(F)cn3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C31H24F2N6O5S/c1-34-30(40)28-24-13-22(26(38(2)45(3,42)43)14-27(24)44-29(28)17-4-7-19(32)8-5-17)18-6-11-25-23(12-18)31(41)39(37-36-25)16-21-10-9-20(33)15-35-21/h4-15H,16H2,1-3H3,(H,34,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.93	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235838 (US9364482, 12) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc2C(=O)N(Cc3ccc(F)cc3)COc2cn1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H26F2N4O6S/c1-35-31(39)29-23-12-22(26(37(2)45(3,41)42)14-27(23)44-30(29)19-6-10-21(34)11-7-19)25-13-24-28(15-36-25)43-17-38(32(24)40)16-18-4-8-20(33)9-5-18/h4-15H,16-17H2,1-3H3,(H,35,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.02	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235855 (US9364482, 29) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2CN(Cc3ccc(F)cc3)C(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H26F2N4O5S/c1-35-31(39)28-24-14-23(25-13-8-20-17-38(32(40)29(20)36-25)16-18-4-9-21(33)10-5-18)26(37(2)44(3,41)42)15-27(24)43-30(28)19-6-11-22(34)12-7-19/h4-15H,16-17H2,1-3H3,(H,35,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.21	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235885 (US9364482, 66) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n([C@H](CCO)c3ccc(F)cc3)c(=O)c2n1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C35H31F2N5O6S/c1-19-39-27-14-13-26(40-32(27)35(45)42(19)28(15-16-43)20-5-9-22(36)10-6-20)24-17-25-30(18-29(24)41(3)49(4,46)47)48-33(31(25)34(44)38-2)21-7-11-23(37)12-8-21/h5-14,17-18,28,43H,15-16H2,1-4H3,(H,38,44)/t28-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.29	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235871 (US9364482, 46) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn([C@H](C)c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C33H27F2N5O5S/c1-18(19-5-10-22(34)11-6-19)40-33(42)25-15-21(9-14-27(25)37-38-40)24-16-26-29(17-28(24)39(3)46(4,43)44)45-31(30(26)32(41)36-2)20-7-12-23(35)13-8-20/h5-18H,1-4H3,(H,36,41)/t18-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.65	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235835 (US9364482, 9) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(Cc3ccc(cc3)C#N)C(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H26FN5O6S/c1-36-32(40)29-24-14-23(26(38(2)46(3,42)43)15-28(24)45-31(29)21-8-10-22(34)11-9-21)25-12-13-27-30(37-25)33(41)39(18-44-27)17-20-6-4-19(16-35)5-7-20/h4-15H,17-18H2,1-3H3,(H,36,40)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.03	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235891 (US9364482, 72) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc2c(cc1C)nnn(Cc1ccc(F)cc1)c2=O)-c1ccc(F)cc1 Show InChI InChI=1S/C33H27F2N5O5S/c1-18-13-27-25(33(42)40(38-37-27)17-19-5-9-21(34)10-6-19)14-23(18)24-15-26-29(16-28(24)39(3)46(4,43)44)45-31(30(26)32(41)36-2)20-7-11-22(35)12-8-20/h5-16H,17H2,1-4H3,(H,36,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.62	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235876 (US9364482, 51) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2ncn(Cc3ccc(F)cc3OC)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C34H28F2N4O6S/c1-37-33(41)31-26-15-24(28(39(2)47(4,43)44)16-30(26)46-32(31)19-5-9-22(35)10-6-19)20-8-12-27-25(13-20)34(42)40(18-38-27)17-21-7-11-23(36)14-29(21)45-3/h5-16,18H,17H2,1-4H3,(H,37,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.98	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235884 (US9364482, 65) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n([C@@H](COC)c3ccc(F)cc3)c(=O)c2n1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C35H31F2N5O6S/c1-19-39-27-15-14-26(40-32(27)35(44)42(19)29(18-47-4)20-6-10-22(36)11-7-20)24-16-25-30(17-28(24)41(3)49(5,45)46)48-33(31(25)34(43)38-2)21-8-12-23(37)13-9-21/h6-17,29H,18H2,1-5H3,(H,38,43)/t29-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.28	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235867 (US9364482, 42) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn(Cc3ccccc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C32H26FN5O5S/c1-34-31(39)29-25-16-23(21-11-14-26-24(15-21)32(40)38(36-35-26)18-19-7-5-4-6-8-19)27(37(2)44(3,41)42)17-28(25)43-30(29)20-9-12-22(33)13-10-20/h4-17H,18H2,1-3H3,(H,34,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.48	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235881 (US9364482, 57) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nc(C)n([C@H](C)c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C35H30F2N4O5S/c1-19(21-6-11-24(36)12-7-21)41-20(2)39-29-15-10-23(16-27(29)35(41)43)26-17-28-31(18-30(26)40(4)47(5,44)45)46-33(32(28)34(42)38-3)22-8-13-25(37)14-9-22/h6-19H,1-5H3,(H,38,42)/t19-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.65	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235844 (US9364482, 18) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2C(=O)NC(Nc2n1)c1cccc(F)c1)-c1ccc(F)cc1 Show InChI InChI=1S/C31H25F2N5O5S/c1-34-31(40)26-22-14-21(23-12-11-20-29(35-23)36-28(37-30(20)39)17-5-4-6-19(33)13-17)24(38(2)44(3,41)42)15-25(22)43-27(26)16-7-9-18(32)10-8-16/h4-15,28H,1-3H3,(H,34,40)(H,35,36)(H,37,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10.5	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235889 (US9364482, 70) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc2c(cc1F)nnn(Cc1ccc(F)cc1)c2=O)-c1ccc(F)cc1 Show InChI InChI=1S/C32H24F3N5O5S/c1-36-31(41)29-24-13-22(27(39(2)46(3,43)44)15-28(24)45-30(29)18-6-10-20(34)11-7-18)21-12-23-26(14-25(21)35)37-38-40(32(23)42)16-17-4-8-19(33)9-5-17/h4-15H,16H2,1-3H3,(H,36,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11.3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235892 (US9364482, 73) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc2c(cc1Cl)nnn(Cc1ccc(F)cc1)c2=O)-c1ccc(F)cc1 Show InChI InChI=1S/C32H24ClF2N5O5S/c1-36-31(41)29-24-13-22(27(39(2)46(3,43)44)15-28(24)45-30(29)18-6-10-20(35)11-7-18)21-12-23-26(14-25(21)33)37-38-40(32(23)42)16-17-4-8-19(34)9-5-17/h4-15H,16H2,1-3H3,(H,36,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11.6	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235893 (US9364482, 74) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cc(C)c2nnn(Cc3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H27F2N5O5S/c1-18-13-21(14-26-30(18)37-38-40(33(26)42)17-19-5-9-22(34)10-6-19)24-15-25-28(16-27(24)39(3)46(4,43)44)45-31(29(25)32(41)36-2)20-7-11-23(35)12-8-20/h5-16H,17H2,1-4H3,(H,36,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11.9	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235868 (US9364482, 43) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2nnn(C(CO)c3ccccc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C33H28FN5O6S/c1-35-32(41)30-25-16-23(27(38(2)46(3,43)44)17-29(25)45-31(30)20-9-12-22(34)13-10-20)21-11-14-26-24(15-21)33(42)39(37-36-26)28(18-40)19-7-5-4-6-8-19/h4-17,28,40H,18H2,1-3H3,(H,35,41)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	15.1	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235837 (US9364482, 11) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1ccc2OCN(Cc3ccc(F)cn3)C(=O)c2n1)-c1ccc(F)cc1 Show InChI InChI=1S/C31H25F2N5O6S/c1-34-30(39)27-22-12-21(24(37(2)45(3,41)42)13-26(22)44-29(27)17-4-6-18(32)7-5-17)23-10-11-25-28(36-23)31(40)38(16-43-25)15-20-9-8-19(33)14-35-20/h4-14H,15-16H2,1-3H3,(H,34,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	15.3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair
Genome polyprotein [1027-1711] (Hepatitis C virus genotype 1a (strain H77) (HCV))	BDBM235848 (US9364482, 22) Show SMILES CNC(=O)c1c(oc2cc(N(C)S(C)(=O)=O)c(cc12)-c1cnc2ncn(-c3ccc(F)cc3)c(=O)c2c1)-c1ccc(F)cc1 Show InChI InChI=1S/C31H23F2N5O5S/c1-34-30(39)27-23-13-22(18-12-24-29(35-15-18)36-16-38(31(24)40)21-10-8-20(33)9-11-21)25(37(2)44(3,41)42)14-26(23)43-28(27)17-4-6-19(32)7-5-17/h4-16H,1-3H3,(H,34,39)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16.2	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Stable neomycin phosphotransferase encoding replicons-harboring cell lines were used, so all cell lines were maintained under G418 selection prior to...				US Patent US9364482 (2016) BindingDB Entry DOI: 10.7270/Q2TT4PVB
					More data for this Ligand-Target Pair

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