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Patent code US9428469

Compile Data Set for Download or QSAR
Found 30 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245435
PNG
(US9428469, 16)
Show SMILES Clc1cc(Cl)cc(Nc2n[nH]c(NCc3ccc(cc3)C#N)n2)c1
Show InChI InChI=1S/C16H12Cl2N6/c17-12-5-13(18)7-14(6-12)21-16-22-15(23-24-16)20-9-11-3-1-10(8-19)2-4-11/h1-7H,9H2,(H3,20,21,22,23,24)
PDB

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n/an/an/an/a 3.34E+3n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245427
PNG
(US9428469, 8)
Show SMILES CC(C)(C)OC(=O)c1ccccc1CNc1nc(Nc2cc(Cl)cc(Cl)c2)n[nH]1
Show InChI InChI=1S/C20H21Cl2N5O2/c1-20(2,3)29-17(28)16-7-5-4-6-12(16)11-23-18-25-19(27-26-18)24-15-9-13(21)8-14(22)10-15/h4-10H,11H2,1-3H3,(H3,23,24,25,26,27)
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n/an/an/an/a 9.99E+3n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245444
PNG
(US9428469, 26)
Show SMILES FC(F)(F)c1cccc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)c1
Show InChI InChI=1S/C16H12Cl2F3N5/c17-11-5-12(18)7-13(6-11)23-15-24-14(25-26-15)22-8-9-2-1-3-10(4-9)16(19,20)21/h1-7H,8H2,(H3,22,23,24,25,26)
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n/an/an/an/a 709n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245442
PNG
(US9428469, 24)
Show SMILES CC(C)S(=O)(=O)c1ccc(cc1)-c1c(Cl)cc(Nc2n[nH]c(NCc3ccc(cc3)C(=O)OC(C)(C)C)n2)cc1C(F)(F)F
Show InChI InChI=1S/C30H31ClF3N5O4S/c1-17(2)44(41,42)22-12-10-19(11-13-22)25-23(30(32,33)34)14-21(15-24(25)31)36-28-37-27(38-39-28)35-16-18-6-8-20(9-7-18)26(40)43-29(3,4)5/h6-15,17H,16H2,1-5H3,(H3,35,36,37,38,39)
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n/an/an/an/a 14n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245443
PNG
(US9428469, 25)
Show SMILES FC(F)(F)c1ccc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)cc1
Show InChI InChI=1S/C16H12Cl2F3N5/c17-11-5-12(18)7-13(6-11)23-15-24-14(25-26-15)22-8-9-1-3-10(4-2-9)16(19,20)21/h1-7H,8H2,(H3,22,23,24,25,26)
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n/an/an/an/a 46n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245420
PNG
(US9428469, 1)
Show SMILES FC(F)(F)c1ccc(CNc2nc(Nc3cc(Cl)c(Br)c(c3)C(F)(F)F)n[nH]2)cc1
Show InChI InChI=1S/C17H11BrClF6N5/c18-13-11(17(23,24)25)5-10(6-12(13)19)27-15-28-14(29-30-15)26-7-8-1-3-9(4-2-8)16(20,21)22/h1-6H,7H2,(H3,26,27,28,29,30)
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n/an/an/an/a 1.35E+3n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245421
PNG
(US9428469, 2)
Show SMILES Clc1cc(Cl)cc(Nc2n[nH]c(NCc3ccco3)n2)c1
Show InChI InChI=1S/C13H11Cl2N5O/c14-8-4-9(15)6-10(5-8)17-13-18-12(19-20-13)16-7-11-2-1-3-21-11/h1-6H,7H2,(H3,16,17,18,19,20)
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n/an/an/an/a 2.58E+3n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245425
PNG
(US9428469, 6)
Show SMILES CC(C)(C)OC(=O)Nc1ccc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)cn1
Show InChI InChI=1S/C19H21Cl2N7O2/c1-19(2,3)30-18(29)25-15-5-4-11(9-22-15)10-23-16-26-17(28-27-16)24-14-7-12(20)6-13(21)8-14/h4-9H,10H2,1-3H3,(H,22,25,29)(H3,23,24,26,27,28)
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n/an/an/an/a 7.81E+3n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245441
PNG
(US9428469, 23)
Show SMILES CC(C)(C)OC(=O)c1ccc(CNc2nc(Nc3cc(Cl)c(C#N)c(Cl)c3)n[nH]2)cc1
Show InChI InChI=1S/C21H20Cl2N6O2/c1-21(2,3)31-18(30)13-6-4-12(5-7-13)11-25-19-27-20(29-28-19)26-14-8-16(22)15(10-24)17(23)9-14/h4-9H,11H2,1-3H3,(H3,25,26,27,28,29)
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n/an/an/an/a 29n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245448
PNG
(US9428469, 30)
Show SMILES CC(=O)N1CCC(CC1)Nc1nc(Nc2cc(Cl)cc(Cl)c2)n[nH]1
Show InChI InChI=1S/C15H18Cl2N6O/c1-9(24)23-4-2-12(3-5-23)18-14-20-15(22-21-14)19-13-7-10(16)6-11(17)8-13/h6-8,12H,2-5H2,1H3,(H3,18,19,20,21,22)
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n/an/an/an/a 9.58E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245422
PNG
(BDBM245430 | US9428469, 3)
Show SMILES Cn1cc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)cn1
Show InChI InChI=1S/C13H13Cl2N7/c1-22-7-8(6-17-22)5-16-12-19-13(21-20-12)18-11-3-9(14)2-10(15)4-11/h2-4,6-7H,5H2,1H3,(H3,16,18,19,20,21)
PDB

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n/an/an/an/a 3.27E+3n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245423
PNG
(US9428469, 4)
Show SMILES FC(F)(F)c1ccc(Cl)cc1CNc1nc(Nc2cc(Cl)cc(Cl)c2)n[nH]1
Show InChI InChI=1S/C16H11Cl3F3N5/c17-9-1-2-13(16(20,21)22)8(3-9)7-23-14-25-15(27-26-14)24-12-5-10(18)4-11(19)6-12/h1-6H,7H2,(H3,23,24,25,26,27)
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n/an/an/an/a 4.66E+3n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245429
PNG
(US9428469, 10)
Show SMILES Nc1ccc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)cn1
Show InChI InChI=1S/C14H13Cl2N7/c15-9-3-10(16)5-11(4-9)20-14-21-13(22-23-14)19-7-8-1-2-12(17)18-6-8/h1-6H,7H2,(H2,17,18)(H3,19,20,21,22,23)
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n/an/an/an/a 5.83E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245437
PNG
(US9428469, 19)
Show SMILES FC(F)(F)c1ccc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)cc1Cl
Show InChI InChI=1S/C16H11Cl3F3N5/c17-9-4-10(18)6-11(5-9)24-15-25-14(26-27-15)23-7-8-1-2-12(13(19)3-8)16(20,21)22/h1-6H,7H2,(H3,23,24,25,26,27)
PDB

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n/an/an/an/a 4.83E+3n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245440
PNG
(US9428469, 22)
Show SMILES FC(F)(F)c1ccc(CNc2nc(Nc3cc(Cl)c(C#N)c(Cl)c3)n[nH]2)cc1
Show InChI InChI=1S/C17H11Cl2F3N6/c18-13-5-11(6-14(19)12(13)7-23)25-16-26-15(27-28-16)24-8-9-1-3-10(4-2-9)17(20,21)22/h1-6H,8H2,(H3,24,25,26,27,28)
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n/an/an/an/a 224n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245446
PNG
(US9428469, 28)
Show SMILES CC(C)(C)OC(=O)N1CCC(CC1)Nc1nc(Nc2cc(Cl)cc(Cl)c2)n[nH]1
Show InChI InChI=1S/C18H24Cl2N6O2/c1-18(2,3)28-17(27)26-6-4-13(5-7-26)21-15-23-16(25-24-15)22-14-9-11(19)8-12(20)10-14/h8-10,13H,4-7H2,1-3H3,(H3,21,22,23,24,25)
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n/an/an/an/a 6.57E+3n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245449
PNG
(US9428469, 31)
Show SMILES Clc1cc(Cl)cc(Nc2n[nH]c(NCc3cncnc3)n2)c1
Show InChI InChI=1S/C13H11Cl2N7/c14-9-1-10(15)3-11(2-9)19-13-20-12(21-22-13)18-6-8-4-16-7-17-5-8/h1-5,7H,6H2,(H3,18,19,20,21,22)
PDB

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n/an/an/an/a 4.43E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245422
PNG
(BDBM245430 | US9428469, 3)
Show SMILES Cn1cc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)cn1
Show InChI InChI=1S/C13H13Cl2N7/c1-22-7-8(6-17-22)5-16-12-19-13(21-20-12)18-11-3-9(14)2-10(15)4-11/h2-4,6-7H,5H2,1H3,(H3,16,18,19,20,21)
PDB

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n/an/an/an/a 2.39E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245431
PNG
(US9428469, 12)
Show SMILES OC(=O)c1ccc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)cc1
Show InChI InChI=1S/C16H13Cl2N5O2/c17-11-5-12(18)7-13(6-11)20-16-21-15(22-23-16)19-8-9-1-3-10(4-2-9)14(24)25/h1-7H,8H2,(H,24,25)(H3,19,20,21,22,23)
PDB

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n/an/an/an/a 1.95E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245432
PNG
(US9428469, 13)
Show SMILES OC(=O)c1cccc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)c1
Show InChI InChI=1S/C16H13Cl2N5O2/c17-11-5-12(18)7-13(6-11)20-16-21-15(22-23-16)19-8-9-2-1-3-10(4-9)14(24)25/h1-7H,8H2,(H,24,25)(H3,19,20,21,22,23)
PDB

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n/an/an/an/a 3.75E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245433
PNG
(US9428469, 14)
Show SMILES OC(=O)c1ccccc1CNc1nc(Nc2cc(Cl)cc(Cl)c2)n[nH]1
Show InChI InChI=1S/C16H13Cl2N5O2/c17-10-5-11(18)7-12(6-10)20-16-21-15(22-23-16)19-8-9-3-1-2-4-13(9)14(24)25/h1-7H,8H2,(H,24,25)(H3,19,20,21,22,23)
PDB

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n/an/an/an/a 9.60E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245434
PNG
(US9428469, 15)
Show SMILES CS(=O)(=O)c1ccc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)cc1
Show InChI InChI=1S/C16H15Cl2N5O2S/c1-26(24,25)14-4-2-10(3-5-14)9-19-15-21-16(23-22-15)20-13-7-11(17)6-12(18)8-13/h2-8H,9H2,1H3,(H3,19,20,21,22,23)
PDB

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US Patent
n/an/an/an/a 1.00E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245439
PNG
(US9428469, 21)
Show SMILES Clc1cc(Cl)cc(Nc2n[nH]c(NCc3ccc(cc3)S(=O)(=O)N3CCOCC3)n2)c1
Show InChI InChI=1S/C19H20Cl2N6O3S/c20-14-9-15(21)11-16(10-14)23-19-24-18(25-26-19)22-12-13-1-3-17(4-2-13)31(28,29)27-5-7-30-8-6-27/h1-4,9-11H,5-8,12H2,(H3,22,23,24,25,26)
PDB

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n/an/an/an/a 1.00E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245445
PNG
(US9428469, 27)
Show SMILES CS(=O)(=O)N1CCC(CC1)Nc1nc(Nc2cc(Cl)cc(Cl)c2)n[nH]1
Show InChI InChI=1S/C14H18Cl2N6O2S/c1-25(23,24)22-4-2-11(3-5-22)17-13-19-14(21-20-13)18-12-7-9(15)6-10(16)8-12/h6-8,11H,2-5H2,1H3,(H3,17,18,19,20,21)
PDB

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n/an/an/an/a 5.96E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245447
PNG
(US9428469, 29)
Show SMILES Clc1cc(Cl)cc(Nc2n[nH]c(NC3CCNCC3)n2)c1
Show InChI InChI=1S/C13H16Cl2N6/c14-8-5-9(15)7-11(6-8)18-13-19-12(20-21-13)17-10-1-3-16-4-2-10/h5-7,10,16H,1-4H2,(H3,17,18,19,20,21)
PDB

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n/an/an/an/a 1.00E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245424
PNG
(US9428469, 5)
Show SMILES Clc1ccc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)nc1
Show InChI InChI=1S/C14H11Cl3N6/c15-8-1-2-11(18-6-8)7-19-13-21-14(23-22-13)20-12-4-9(16)3-10(17)5-12/h1-6H,7H2,(H3,19,20,21,22,23)
PDB

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n/an/an/an/a 1.57E+3n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245428
PNG
(US9428469, 9)
Show SMILES Clc1cc(Cl)cc(Nc2n[nH]c(NCc3ccccc3)n2)c1
Show InChI InChI=1S/C15H13Cl2N5/c16-11-6-12(17)8-13(7-11)19-15-20-14(21-22-15)18-9-10-4-2-1-3-5-10/h1-8H,9H2,(H3,18,19,20,21,22)
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n/an/an/an/a 1.72E+3n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245436
PNG
(US9428469, 17)
Show SMILES CN(C)S(=O)(=O)c1ccc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)cc1
Show InChI InChI=1S/C17H18Cl2N6O2S/c1-25(2)28(26,27)15-5-3-11(4-6-15)10-20-16-22-17(24-23-16)21-14-8-12(18)7-13(19)9-14/h3-9H,10H2,1-2H3,(H3,20,21,22,23,24)
PDB

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n/an/an/an/a 1.00E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245426
PNG
(US9428469, 7)
Show SMILES CC(C)(C)OC(=O)c1ccc(CNc2nc(Nc3cc(Cl)cc(Cl)c3)n[nH]2)cc1
Show InChI InChI=1S/C20H21Cl2N5O2/c1-20(2,3)29-17(28)13-6-4-12(5-7-13)11-23-18-25-19(27-26-18)24-16-9-14(21)8-15(22)10-16/h4-10H,11H2,1-3H3,(H3,23,24,25,26,27)
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n/an/an/an/a 414n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
Genome polyprotein [192-746]


(Hepatitis C virus genotype 1b (isolate Con1) (HCV))		BDBM245438
PNG
(US9428469, 20)
Show SMILES Clc1cc(Cl)cc(Nc2n[nH]c(NCc3ccc(cc3)S(=O)(=O)N3CCCC3)n2)c1
Show InChI InChI=1S/C19H20Cl2N6O2S/c20-14-9-15(21)11-16(10-14)23-19-24-18(25-26-19)22-12-13-3-5-17(6-4-13)30(28,29)27-7-1-2-8-27/h3-6,9-11H,1-2,7-8,12H2,(H3,22,23,24,25,26)
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n/an/an/an/a 1.00E+4n/an/an/a37



HOFFMANN-LA ROCHE

US Patent


Assay Description
Huh7-high CD81 cells were plated at a cell density of 8000 cells per well in 96 well plates (Perkin Elmer, cat #6005660). Cells were plated in 100 &m...

US Patent US9428469 (2016)


BindingDB Entry DOI: 10.7270/Q21G0K6G
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%