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15 molecules are shown

Wt: 537.6
BDBM30407
Wt: 474.5
BDBM30422
Wt: 444.5
BDBM30423
Wt: 460.5
BDBM30424
Wt: 517.5
BDBM30425
Wt: 533.5
BDBM30430
Wt: 499.5
BDBM30434
Wt: 515.6
BDBM30435
Wt: 527.6
BDBM30437
Wt: 501.5
BDBM30438
Wt: 527.6
BDBM30439
Wt: 486.5
BDBM30443
Wt: 469.5
BDBM30444
Wt: 487.5
BDBM30445
Wt: 511.5
BDBM30446

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 16 hits for monomerid = 30407,30422,30423,30424,30425,30430,30434,30435,30437,30438,30439,30443,30444,30445,30446   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30407
PNG
(5-hydroxy- 3(2H)-pyridazinone, 2 | BMCL185002 Comp...)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(NS(C)(=O)=O)cc3S(=O)(=O)N2)c1=O
Show InChI InChI=1S/C21H23N5O6S3/c1-12(2)8-9-26-21(28)17(19(27)18(23-26)15-5-4-10-33-15)20-22-14-7-6-13(24-34(3,29)30)11-16(14)35(31,32)25-20/h4-7,10-12,24,27H,8-9H2,1-3H3,(H,22,25)
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n/an/a<10n/a 5n/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 3616-21 (2008)


Article DOI: 10.1016/j.bmcl.2008.04.066
BindingDB Entry DOI: 10.7270/Q26D5R9N
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30407
PNG
(5-hydroxy- 3(2H)-pyridazinone, 2 | BMCL185002 Comp...)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(NS(C)(=O)=O)cc3S(=O)(=O)N2)c1=O
Show InChI InChI=1S/C21H23N5O6S3/c1-12(2)8-9-26-21(28)17(19(27)18(23-26)15-5-4-10-33-15)20-22-14-7-6-13(24-34(3,29)30)11-16(14)35(31,32)25-20/h4-7,10-12,24,27H,8-9H2,1-3H3,(H,22,25)
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n/an/a<10n/a 5n/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 5002-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.08.017
BindingDB Entry DOI: 10.7270/Q2XW4H5X
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30423
PNG
(pyridazinone derivative, 8b)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccccc3S(=O)(=O)N2)c1=O
Show InChI InChI=1S/C20H20N4O4S2/c1-12(2)9-10-24-20(26)16(18(25)17(22-24)14-7-5-11-29-14)19-21-13-6-3-4-8-15(13)30(27,28)23-19/h3-8,11-12,25H,9-10H2,1-2H3,(H,21,23)
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n/an/a 1.30E+3n/a 7.10E+3n/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30424
PNG
(pyridazinone derivative, 8c)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(O)cc3S(=O)(=O)N2)c1=O
Show InChI InChI=1S/C20H20N4O5S2/c1-11(2)7-8-24-20(27)16(18(26)17(22-24)14-4-3-9-30-14)19-21-13-6-5-12(25)10-15(13)31(28,29)23-19/h3-6,9-11,25-26H,7-8H2,1-2H3,(H,21,23)
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n/an/a 340n/a 6.50E+3n/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30425
PNG
(pyridazinone derivative, 8d)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(OCC(N)=O)cc3S(=O)(=O)N2)c1=O
Show InChI InChI=1S/C22H23N5O6S2/c1-12(2)7-8-27-22(30)18(20(29)19(25-27)15-4-3-9-34-15)21-24-14-6-5-13(33-11-17(23)28)10-16(14)35(31,32)26-21/h3-6,9-10,12,29H,7-8,11H2,1-2H3,(H2,23,28)(H,24,26)
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n/an/a 70n/a 410n/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30430
PNG
(pyridazinone derivative, 8i)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(OCC(=O)NO)cc3S(=O)(=O)N2)c1=O
Show InChI InChI=1S/C22H23N5O7S2/c1-12(2)7-8-27-22(30)18(20(29)19(24-27)15-4-3-9-35-15)21-23-14-6-5-13(34-11-17(28)25-31)10-16(14)36(32,33)26-21/h3-6,9-10,12,29,31H,7-8,11H2,1-2H3,(H,23,26)(H,25,28)
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n/an/a 100n/a 1.10E+3n/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30434
PNG
(pyridazinone derivative, 8m)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(OCC#N)cc3S(=O)(=O)N2)c1=O
Show InChI InChI=1S/C22H21N5O5S2/c1-13(2)7-9-27-22(29)18(20(28)19(25-27)16-4-3-11-33-16)21-24-15-6-5-14(32-10-8-23)12-17(15)34(30,31)26-21/h3-6,11-13,28H,7,9-10H2,1-2H3,(H,24,26)
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n/an/a 570n/a 540n/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30435
PNG
(pyridazinone derivative, 8n)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(CCC(N)=O)cc3S(=O)(=O)N2)c1=O
Show InChI InChI=1S/C23H25N5O5S2/c1-13(2)9-10-28-23(31)19(21(30)20(26-28)16-4-3-11-34-16)22-25-15-7-5-14(6-8-18(24)29)12-17(15)35(32,33)27-22/h3-5,7,11-13,30H,6,8-10H2,1-2H3,(H2,24,29)(H,25,27)
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n/an/a 3.40E+3n/an/an/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30437
PNG
(pyridazinone derivative, 8p)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(NC(=O)C4CC4)cc3S(=O)(=O)N2)c1=O
Show InChI InChI=1S/C24H25N5O5S2/c1-13(2)9-10-29-24(32)19(21(30)20(27-29)17-4-3-11-35-17)22-26-16-8-7-15(25-23(31)14-5-6-14)12-18(16)36(33,34)28-22/h3-4,7-8,11-14,30H,5-6,9-10H2,1-2H3,(H,25,31)(H,26,28)
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n/an/a 8.00E+3n/an/an/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30438
PNG
(pyridazinone derivative, 8q)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(NC(C)=O)cc3S(=O)(=O)N2)c1=O
Show InChI InChI=1S/C22H23N5O5S2/c1-12(2)8-9-27-22(30)18(20(29)19(25-27)16-5-4-10-33-16)21-24-15-7-6-14(23-13(3)28)11-17(15)34(31,32)26-21/h4-7,10-12,29H,8-9H2,1-3H3,(H,23,28)(H,24,26)
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n/an/a 1.10E+3n/an/an/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30439
PNG
(pyridazinone derivative, 8r)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(cc3S(=O)(=O)N2)N2CCCC2=O)c1=O
Show InChI InChI=1S/C24H25N5O5S2/c1-14(2)9-11-29-24(32)20(22(31)21(26-29)17-5-4-12-35-17)23-25-16-8-7-15(28-10-3-6-19(28)30)13-18(16)36(33,34)27-23/h4-5,7-8,12-14,31H,3,6,9-11H2,1-2H3,(H,25,27)
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n/an/a 7.20E+3n/an/an/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30443
PNG
(pyridazinone derivative, 8v)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(cc3S(=O)(=O)N2)C(C)=O)c1=O
Show InChI InChI=1S/C22H22N4O5S2/c1-12(2)8-9-26-22(29)18(20(28)19(24-26)16-5-4-10-32-16)21-23-15-7-6-14(13(3)27)11-17(15)33(30,31)25-21/h4-7,10-12,28H,8-9H2,1-3H3,(H,23,25)
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n/an/a 2.50E+3n/an/an/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30444
PNG
(pyridazinone derivative, 8w)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(cc3S(=O)(=O)N2)C#N)c1=O
Show InChI InChI=1S/C21H19N5O4S2/c1-12(2)7-8-26-21(28)17(19(27)18(24-26)15-4-3-9-31-15)20-23-14-6-5-13(11-22)10-16(14)32(29,30)25-20/h3-6,9-10,12,27H,7-8H2,1-2H3,(H,23,25)
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n/an/a 710n/an/an/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30445
PNG
(pyridazinone derivative, 8x)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(cc3S(=O)(=O)N2)C(N)=O)c1=O
Show InChI InChI=1S/C21H21N5O5S2/c1-11(2)7-8-26-21(29)16(18(27)17(24-26)14-4-3-9-32-14)20-23-13-6-5-12(19(22)28)10-15(13)33(30,31)25-20/h3-6,9-11,27H,7-8H2,1-2H3,(H2,22,28)(H,23,25)
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n/an/a 580n/an/an/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30446
PNG
(pyridazinone derivative, 8y)
Show SMILES CC(C)CCn1nc(-c2cccs2)c(O)c(C2=Nc3ccc(cc3S(=O)(=O)N2)-c2c[nH]nn2)c1=O
Show InChI InChI=1S/C22H21N7O4S2/c1-12(2)7-8-29-22(31)18(20(30)19(26-29)16-4-3-9-34-16)21-24-14-6-5-13(15-11-23-28-25-15)10-17(14)35(32,33)27-21/h3-6,9-12,30H,7-8H2,1-2H3,(H,24,27)(H,23,25,28)
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n/an/a 290n/an/an/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair
Non-structural protein 5B (NS5B)


(Hepatitis C virus genotype 1b (isolate BK) (HCV))
BDBM30422
PNG
(pyridazinone derivative, 8a)
Show SMILES COc1ccc2N=C(NS(=O)(=O)c2c1)c1c(O)c(nn(CCC(C)C)c1=O)-c1cccs1
Show InChI InChI=1S/C21H22N4O5S2/c1-12(2)8-9-25-21(27)17(19(26)18(23-25)15-5-4-10-31-15)20-22-14-7-6-13(30-3)11-16(14)32(28,29)24-20/h4-7,10-12,26H,8-9H2,1-3H3,(H,22,24)
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n/an/a 3.80E+3n/a 2.60E+4n/an/a7.528



Anadys Pharmaceuticals



Assay Description
Assays were performed in a 96-well streptavidin-coated Flash-Plate using enzyme, RNA substrate, and [alpha-33P]GTP/GTP with inhibitor concentration v...


Bioorg Med Chem Lett 18: 1413-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.007
BindingDB Entry DOI: 10.7270/Q22N50MR
More data for this
Ligand-Target Pair