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PubMed code 15261274

Compile data set for download or QSAR
Found 28 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
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150374
PNG
(2-[(2-Bromo-6-methoxy-5-trifluoromethyl-naphthalen...)
Show SMILES COc1ccc2c(C(=O)NC(CCC(O)=O)C(O)=O)c(Br)ccc2c1C(F)(F)F
Show InChI InChI=1S/C18H15BrF3NO6/c1-29-12-6-3-8-9(15(12)18(20,21)22)2-4-10(19)14(8)16(26)23-11(17(27)28)5-7-13(24)25/h2-4,6,11H,5,7H2,1H3,(H,23,26)(H,24,25)(H,27,28)
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n/an/a 120n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150385
PNG
(2-[(6-Methoxy-5-trifluoromethyl-naphthalene-1-carb...)
Show SMILES COc1ccc2c(cccc2c1C(F)(F)F)C(=O)NC(CCC(O)=O)C(O)=O
Show InChI InChI=1S/C18H16F3NO6/c1-28-13-7-5-9-10(15(13)18(19,20)21)3-2-4-11(9)16(25)22-12(17(26)27)6-8-14(23)24/h2-5,7,12H,6,8H2,1H3,(H,22,25)(H,23,24)(H,26,27)
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150365
PNG
(2-[(5-Bromo-6-methoxy-naphthalene-1-carbonyl)-amin...)
Show SMILES COc1ccc2c(cccc2c1Br)C(=O)NC(CCC(O)=O)C(O)=O
Show InChI InChI=1S/C17H16BrNO6/c1-25-13-7-5-9-10(15(13)18)3-2-4-11(9)16(22)19-12(17(23)24)6-8-14(20)21/h2-5,7,12H,6,8H2,1H3,(H,19,22)(H,20,21)(H,23,24)
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150370
PNG
(CHEMBL183364 | [Carboxymethyl-(6-methoxy-5-trifluo...)
Show SMILES COc1ccc2c(cccc2c1C(F)(F)F)C(=O)N(CC(O)=O)CC(O)=O
Show InChI InChI=1S/C17H14F3NO6/c1-27-12-6-5-9-10(15(12)17(18,19)20)3-2-4-11(9)16(26)21(7-13(22)23)8-14(24)25/h2-6H,7-8H2,1H3,(H,22,23)(H,24,25)
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150368
PNG
(2-[(2-Bromo-6-methoxy-5-trifluoromethyl-naphthalen...)
Show SMILES COc1ccc2c(C(=O)NC(CC(O)=O)C(O)=O)c(Br)ccc2c1C(F)(F)F
Show InChI InChI=1S/C17H13BrF3NO6/c1-28-11-5-3-7-8(14(11)17(19,20)21)2-4-9(18)13(7)15(25)22-10(16(26)27)6-12(23)24/h2-5,10H,6H2,1H3,(H,22,25)(H,23,24)(H,26,27)
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n/an/a 910n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150375
PNG
(2-[(5-Bromo-6-methoxy-naphthalene-1-carbonyl)-amin...)
Show SMILES COc1ccc2c(cccc2c1Br)C(=O)NC(CC(O)=O)C(O)=O
Show InChI InChI=1S/C16H14BrNO6/c1-24-12-6-5-8-9(14(12)17)3-2-4-10(8)15(21)18-11(16(22)23)7-13(19)20/h2-6,11H,7H2,1H3,(H,18,21)(H,19,20)(H,22,23)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150382
PNG
(2-[(6-Methoxy-5-trifluoromethyl-naphthalene-1-carb...)
Show SMILES COc1ccc2c(cccc2c1C(F)(F)F)C(=O)NC(CC(O)=O)C(O)=O
Show InChI InChI=1S/C17H14F3NO6/c1-27-12-6-5-8-9(14(12)17(18,19)20)3-2-4-10(8)15(24)21-11(16(25)26)7-13(22)23/h2-6,11H,7H2,1H3,(H,21,24)(H,22,23)(H,25,26)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150379
PNG
(2-[(2-Fluoro-6-methoxy-5-trifluoromethyl-naphthale...)
Show SMILES COc1ccc2c(C(=O)NC(CCC(O)=O)C(O)=O)c(F)ccc2c1C(F)(F)F
Show InChI InChI=1S/C18H15F4NO6/c1-29-12-6-3-8-9(15(12)18(20,21)22)2-4-10(19)14(8)16(26)23-11(17(27)28)5-7-13(24)25/h2-4,6,11H,5,7H2,1H3,(H,23,26)(H,24,25)(H,27,28)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150369
PNG
(CHEMBL83984 | [(2-Bromo-6-methoxy-5-trifluoromethy...)
Show SMILES COC(=O)N(CC(O)=O)C(=O)c1c(Br)ccc2c(c(OC)ccc12)C(F)(F)F
Show InChI InChI=1S/C17H13BrF3NO6/c1-27-11-6-4-8-9(14(11)17(19,20)21)3-5-10(18)13(8)15(25)22(7-12(23)24)16(26)28-2/h3-6H,7H2,1-2H3,(H,23,24)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150378
PNG
(CHEMBL316179 | [(2-Bromo-6-methoxy-5-trifluorometh...)
Show SMILES COc1ccc2c(C(=O)N(C)CC(O)=O)c(Br)ccc2c1C(F)(F)F
Show InChI InChI=1S/C16H13BrF3NO4/c1-21(7-12(22)23)15(24)13-8-4-6-11(25-2)14(16(18,19)20)9(8)3-5-10(13)17/h3-6H,7H2,1-2H3,(H,22,23)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150381
PNG
(2-[(2-Fluoro-6-methoxy-5-trifluoromethyl-naphthale...)
Show SMILES COc1ccc2c(C(=O)NC(CC(O)=O)C(O)=O)c(F)ccc2c1C(F)(F)F
Show InChI InChI=1S/C17H13F4NO6/c1-28-11-5-3-7-8(14(11)17(19,20)21)2-4-9(18)13(7)15(25)22-10(16(26)27)6-12(23)24/h2-5,10H,6H2,1H3,(H,22,25)(H,23,24)(H,26,27)
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n/an/a 2.10E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150377
PNG
(CHEMBL182728 | [(2-Bromo-6-methoxy-5-trifluorometh...)
Show SMILES COc1ccc2c(C(=O)N(CC(O)=O)C(=O)OCC#C)c(Br)ccc2c1C(F)(F)F
Show InChI InChI=1S/C19H13BrF3NO6/c1-3-8-30-18(28)24(9-14(25)26)17(27)15-10-5-7-13(29-2)16(19(21,22)23)11(10)4-6-12(15)20/h1,4-7H,8-9H2,2H3,(H,25,26)
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n/an/a 2.90E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150366
PNG
(CHEMBL82516 | [(2-Bromo-6-methoxy-5-trifluoromethy...)
Show SMILES CCOC(=O)N(CC(O)=O)C(=O)c1c(Br)ccc2c(c(OC)ccc12)C(F)(F)F
Show InChI InChI=1S/C18H15BrF3NO6/c1-3-29-17(27)23(8-13(24)25)16(26)14-9-5-7-12(28-2)15(18(20,21)22)10(9)4-6-11(14)19/h4-7H,3,8H2,1-2H3,(H,24,25)
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n/an/a 3.10E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150376
PNG
(CHEMBL183498 | [Allyloxycarbonyl-(2-bromo-6-methox...)
Show SMILES COc1ccc2c(C(=O)N(CC(O)=O)C(=O)OCC=C)c(Br)ccc2c1C(F)(F)F
Show InChI InChI=1S/C19H15BrF3NO6/c1-3-8-30-18(28)24(9-14(25)26)17(27)15-10-5-7-13(29-2)16(19(21,22)23)11(10)4-6-12(15)20/h3-7H,1,8-9H2,2H3,(H,25,26)
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n/an/a 3.30E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150373
PNG
(CHEMBL183575 | [(2-Bromo-6-methoxy-5-trifluorometh...)
Show SMILES CCCOC(=O)N(CC(O)=O)C(=O)c1c(Br)ccc2c(c(OC)ccc12)C(F)(F)F
Show InChI InChI=1S/C19H17BrF3NO6/c1-3-8-30-18(28)24(9-14(25)26)17(27)15-10-5-7-13(29-2)16(19(21,22)23)11(10)4-6-12(15)20/h4-7H,3,8-9H2,1-2H3,(H,25,26)
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n/an/a 4.90E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150371
PNG
(CHEMBL84384 | [(2-Chloro-6-methoxy-5-trifluorometh...)
Show SMILES COC(=O)N(CC(O)=O)C(=O)c1c(Cl)ccc2c(c(OC)ccc12)C(F)(F)F
Show InChI InChI=1S/C17H13ClF3NO6/c1-27-11-6-4-8-9(14(11)17(19,20)21)3-5-10(18)13(8)15(25)22(7-12(23)24)16(26)28-2/h3-6H,7H2,1-2H3,(H,23,24)
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n/an/a 5.00E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150362
PNG
(CHEMBL310098 | [(2-Chloro-6-methoxy-5-trifluoromet...)
Show SMILES COc1ccc2c(C(=O)N(C)CC(O)=O)c(Cl)ccc2c1C(F)(F)F
Show InChI InChI=1S/C16H13ClF3NO4/c1-21(7-12(22)23)15(24)13-8-4-6-11(25-2)14(16(18,19)20)9(8)3-5-10(13)17/h3-6H,7H2,1-2H3,(H,22,23)
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Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150380
PNG
(CHEMBL183968 | [(2-Bromo-6-methoxy-5-trifluorometh...)
Show SMILES COc1ccc2c(C(=O)N(CC(O)=O)C(=O)OCC(C)(C)C)c(Br)ccc2c1C(F)(F)F
Show InChI InChI=1S/C21H21BrF3NO6/c1-20(2,3)10-32-19(30)26(9-15(27)28)18(29)16-11-6-8-14(31-4)17(21(23,24)25)12(11)5-7-13(16)22/h5-8H,9-10H2,1-4H3,(H,27,28)
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n/an/a 6.40E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150364
PNG
(CHEMBL184665 | [(2-Bromo-6-methoxy-5-trifluorometh...)
Show SMILES COc1ccc2c(C(=O)N(CC(O)=O)C(=O)OCC(C)C)c(Br)ccc2c1C(F)(F)F
Show InChI InChI=1S/C20H19BrF3NO6/c1-10(2)9-31-19(29)25(8-15(26)27)18(28)16-11-5-7-14(30-3)17(20(22,23)24)12(11)4-6-13(16)21/h4-7,10H,8-9H2,1-3H3,(H,26,27)
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n/an/a 7.70E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150372
PNG
(2-[(2-Methoxy-naphthalene-1-carbonyl)-amino]-succi...)
Show SMILES COc1ccc2ccccc2c1C(=O)NC(CC(O)=O)C(O)=O
Show InChI InChI=1S/C16H15NO6/c1-23-12-7-6-9-4-2-3-5-10(9)14(12)15(20)17-11(16(21)22)8-13(18)19/h2-7,11H,8H2,1H3,(H,17,20)(H,18,19)(H,21,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150367
PNG
(3-[(2-Bromo-6-methoxy-5-trifluoromethyl-naphthalen...)
Show SMILES COC(=O)N(CCC(O)=O)C(=O)c1c(Br)ccc2c(c(OC)ccc12)C(F)(F)F
Show InChI InChI=1S/C18H15BrF3NO6/c1-28-12-6-4-9-10(15(12)18(20,21)22)3-5-11(19)14(9)16(26)23(17(27)29-2)8-7-13(24)25/h3-6H,7-8H2,1-2H3,(H,24,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150363
PNG
(CHEMBL83762 | [(2,6-Dimethoxy-5-trifluoromethyl-na...)
Show SMILES COC(=O)N(CC(O)=O)C(=O)c1c(OC)ccc2c(c(OC)ccc12)C(F)(F)F
Show InChI InChI=1S/C18H16F3NO7/c1-27-11-6-5-10-9(4-7-12(28-2)15(10)18(19,20)21)14(11)16(25)22(8-13(23)24)17(26)29-3/h4-7H,8H2,1-3H3,(H,23,24)
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n/an/a 1.13E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50010062
PNG
(CHEMBL84152 | [(2-Fluoro-6-methoxy-5-trifluorometh...)
Show SMILES COC(=O)N(CC(O)=O)C(=O)c1c(F)ccc2c(c(OC)ccc12)C(F)(F)F
Show InChI InChI=1S/C17H13F4NO6/c1-27-11-6-4-8-9(14(11)17(19,20)21)3-5-10(18)13(8)15(25)22(7-12(23)24)16(26)28-2/h3-6H,7H2,1-2H3,(H,23,24)
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n/an/a 1.52E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150384
PNG
(CHEMBL184977 | {[2-(4-Chloro-phenyl)-6-methoxy-5-t...)
Show SMILES COC(=O)N(CC(O)=O)C(=O)c1c(ccc2c(c(OC)ccc12)C(F)(F)F)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H17ClF3NO6/c1-33-17-10-9-15-16(20(17)23(25,26)27)8-7-14(12-3-5-13(24)6-4-12)19(15)21(31)28(11-18(29)30)22(32)34-2/h3-10H,11H2,1-2H3,(H,29,30)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
Hepatitis C virus NS5B RNA-dependent RNA polymerase


(Hepatitis C virus)
BDBM50150383
PNG
(CHEMBL310174 | [Methoxycarbonyl-(6-methoxy-5-trifl...)
Show SMILES COC(=O)N(CC(O)=O)C(=O)c1cccc2c(c(OC)ccc12)C(F)(F)F
Show InChI InChI=1S/C17H14F3NO6/c1-26-12-7-6-9-10(14(12)17(18,19)20)4-3-5-11(9)15(24)21(8-13(22)23)16(25)27-2/h3-7H,8H2,1-2H3,(H,22,23)
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n/an/a>2.60E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against HCV NS5B RNA dependent RNA polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
DNA polymerase (alpha/delta/epsilon)


(Homo sapiens (Human))
BDBM50150371
PNG
(CHEMBL84384 | [(2-Chloro-6-methoxy-5-trifluorometh...)
Show SMILES COC(=O)N(CC(O)=O)C(=O)c1c(Cl)ccc2c(c(OC)ccc12)C(F)(F)F
Show InChI InChI=1S/C17H13ClF3NO6/c1-27-11-6-4-8-9(14(11)17(19,20)21)3-5-10(18)13(8)15(25)22(7-12(23)24)16(26)28-2/h3-6H,7H2,1-2H3,(H,23,24)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against calf thymus alpha polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
DNA polymerase beta


(Homo sapiens (Human))
BDBM50150371
PNG
(CHEMBL84384 | [(2-Chloro-6-methoxy-5-trifluorometh...)
Show SMILES COC(=O)N(CC(O)=O)C(=O)c1c(Cl)ccc2c(c(OC)ccc12)C(F)(F)F
Show InChI InChI=1S/C17H13ClF3NO6/c1-27-11-6-4-8-9(14(11)17(19,20)21)3-5-10(18)13(8)15(25)22(7-12(23)24)16(26)28-2/h3-6H,7H2,1-2H3,(H,23,24)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against human beta polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
DNA polymerase (alpha/delta/epsilon)


(Homo sapiens (Human))
BDBM50150371
PNG
(CHEMBL84384 | [(2-Chloro-6-methoxy-5-trifluorometh...)
Show SMILES COC(=O)N(CC(O)=O)C(=O)c1c(Cl)ccc2c(c(OC)ccc12)C(F)(F)F
Show InChI InChI=1S/C17H13ClF3NO6/c1-27-11-6-4-8-9(14(11)17(19,20)21)3-5-10(18)13(8)15(25)22(7-12(23)24)16(26)28-2/h3-6H,7H2,1-2H3,(H,23,24)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against calf thymus alpha polymerase


Bioorg Med Chem Lett 14: 4221-4 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.013
BindingDB Entry DOI: 10.7270/Q2MC8ZFF
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%