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Compile Data Set for Download or QSAR

Found 142 hits Enz. Inhib. hit(s) with all data for entry = 50010207   
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
Polymerase acidic protein


(Hepatitis C virus)
BDBM50508966
PNG
(CHEMBL4452342)
Show SMILES CN(Cc1cc(=O)c(O)cn1-c1ccc(cc1)-c1nnn[nH]1)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H17ClN6O2/c1-26(15-8-4-14(21)5-9-15)11-17-10-18(28)19(29)12-27(17)16-6-2-13(3-7-16)20-22-24-25-23-20/h2-10,12,29H,11H2,1H3,(H,22,23,24,25)
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n/an/a 13n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50508966
PNG
(CHEMBL4452342)
Show SMILES CN(Cc1cc(=O)c(O)cn1-c1ccc(cc1)-c1nnn[nH]1)c1ccc(Cl)cc1
Show InChI InChI=1S/C20H17ClN6O2/c1-26(15-8-4-14(21)5-9-15)11-17-10-18(28)19(29)12-27(17)16-6-2-13(3-7-16)20-22-24-25-23-20/h2-10,12,29H,11H2,1H3,(H,22,23,24,25)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536153
PNG
(CHEMBL4531327)
Show SMILES Cc1cc(=O)c(O)cn1-c1ccc(cc1)-c1nnn[nH]1
Show InChI InChI=1S/C13H11N5O2/c1-8-6-11(19)12(20)7-18(8)10-4-2-9(3-5-10)13-14-16-17-15-13/h2-7,20H,1H3,(H,14,15,16,17)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536153
PNG
(CHEMBL4531327)
Show SMILES Cc1cc(=O)c(O)cn1-c1ccc(cc1)-c1nnn[nH]1
Show InChI InChI=1S/C13H11N5O2/c1-8-6-11(19)12(20)7-18(8)10-4-2-9(3-5-10)13-14-16-17-15-13/h2-7,20H,1H3,(H,14,15,16,17)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536140
PNG
(CHEMBL4591461)
Show SMILES Cc1cc(=O)c(O)cn1-c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C18H15NO3/c1-13-11-17(20)18(21)12-19(13)14-7-9-16(10-8-14)22-15-5-3-2-4-6-15/h2-12,21H,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536140
PNG
(CHEMBL4591461)
Show SMILES Cc1cc(=O)c(O)cn1-c1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C18H15NO3/c1-13-11-17(20)18(21)12-19(13)14-7-9-16(10-8-14)22-15-5-3-2-4-6-15/h2-12,21H,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536156
PNG
(CHEMBL4544434)
Show SMILES Cc1cc(=O)c(O)cn1-c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C13H11NO4/c1-8-6-11(15)12(16)7-14(8)10-4-2-9(3-5-10)13(17)18/h2-7,16H,1H3,(H,17,18)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536156
PNG
(CHEMBL4544434)
Show SMILES Cc1cc(=O)c(O)cn1-c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C13H11NO4/c1-8-6-11(15)12(16)7-14(8)10-4-2-9(3-5-10)13(17)18/h2-7,16H,1H3,(H,17,18)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536102
PNG
(CHEMBL4527067)
Show SMILES Cc1cc(=O)c(O)cn1C1CCCCC1
Show InChI InChI=1S/C12H17NO2/c1-9-7-11(14)12(15)8-13(9)10-5-3-2-4-6-10/h7-8,10,15H,2-6H2,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536102
PNG
(CHEMBL4527067)
Show SMILES Cc1cc(=O)c(O)cn1C1CCCCC1
Show InChI InChI=1S/C12H17NO2/c1-9-7-11(14)12(15)8-13(9)10-5-3-2-4-6-10/h7-8,10,15H,2-6H2,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536144
PNG
(CHEMBL4552407)
Show SMILES CCOC(=O)c1c(C)n(cc(O)c1=O)-c1ccc(cc1)-c1nnn[nH]1
Show InChI InChI=1S/C16H15N5O4/c1-3-25-16(24)13-9(2)21(8-12(22)14(13)23)11-6-4-10(5-7-11)15-17-19-20-18-15/h4-8,22H,3H2,1-2H3,(H,17,18,19,20)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536144
PNG
(CHEMBL4552407)
Show SMILES CCOC(=O)c1c(C)n(cc(O)c1=O)-c1ccc(cc1)-c1nnn[nH]1
Show InChI InChI=1S/C16H15N5O4/c1-3-25-16(24)13-9(2)21(8-12(22)14(13)23)11-6-4-10(5-7-11)15-17-19-20-18-15/h4-8,22H,3H2,1-2H3,(H,17,18,19,20)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536139
PNG
(CHEMBL4565114)
Show SMILES COc1cccc(c1)-n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C13H13NO3/c1-9-6-12(15)13(16)8-14(9)10-4-3-5-11(7-10)17-2/h3-8,16H,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536139
PNG
(CHEMBL4565114)
Show SMILES COc1cccc(c1)-n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C13H13NO3/c1-9-6-12(15)13(16)8-14(9)10-4-3-5-11(7-10)17-2/h3-8,16H,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536111
PNG
(CHEMBL4573788)
Show SMILES COc1ccc(cc1)-n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C13H13NO3/c1-9-7-12(15)13(16)8-14(9)10-3-5-11(17-2)6-4-10/h3-8,16H,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536111
PNG
(CHEMBL4573788)
Show SMILES COc1ccc(cc1)-n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C13H13NO3/c1-9-7-12(15)13(16)8-14(9)10-3-5-11(17-2)6-4-10/h3-8,16H,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536105
PNG
(CHEMBL4543114)
Show SMILES Cc1cc(=O)c(O)cn1-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C13H11NO4/c1-8-5-11(15)12(16)7-14(8)10-4-2-3-9(6-10)13(17)18/h2-7,16H,1H3,(H,17,18)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536105
PNG
(CHEMBL4543114)
Show SMILES Cc1cc(=O)c(O)cn1-c1cccc(c1)C(O)=O
Show InChI InChI=1S/C13H11NO4/c1-8-5-11(15)12(16)7-14(8)10-4-2-3-9(6-10)13(17)18/h2-7,16H,1H3,(H,17,18)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536141
PNG
(CHEMBL4552699)
Show SMILES COC(=O)c1ccc(cc1)-n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C14H13NO4/c1-9-7-12(16)13(17)8-15(9)11-5-3-10(4-6-11)14(18)19-2/h3-8,17H,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536141
PNG
(CHEMBL4552699)
Show SMILES COC(=O)c1ccc(cc1)-n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C14H13NO4/c1-9-7-12(16)13(17)8-15(9)11-5-3-10(4-6-11)14(18)19-2/h3-8,17H,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536161
PNG
(CHEMBL4581519)
Show SMILES COC(=O)c1cccc(c1)-n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C14H13NO4/c1-9-6-12(16)13(17)8-15(9)11-5-3-4-10(7-11)14(18)19-2/h3-8,17H,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536134
PNG
(CHEMBL4586729)
Show SMILES Cc1cc(=O)c(O)cn1-c1ccccc1
Show InChI InChI=1S/C12H11NO2/c1-9-7-11(14)12(15)8-13(9)10-5-3-2-4-6-10/h2-8,15H,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536134
PNG
(CHEMBL4586729)
Show SMILES Cc1cc(=O)c(O)cn1-c1ccccc1
Show InChI InChI=1S/C12H11NO2/c1-9-7-11(14)12(15)8-13(9)10-5-3-2-4-6-10/h2-8,15H,1H3
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n/an/a 501n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536161
PNG
(CHEMBL4581519)
Show SMILES COC(=O)c1cccc(c1)-n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C14H13NO4/c1-9-6-12(16)13(17)8-15(9)11-5-3-4-10(7-11)14(18)19-2/h3-8,17H,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536145
PNG
(CHEMBL4588236)
Show SMILES Cc1c(C(O)=O)c(=O)c(O)cn1-c1ccccc1
Show InChI InChI=1S/C13H11NO4/c1-8-11(13(17)18)12(16)10(15)7-14(8)9-5-3-2-4-6-9/h2-7,15H,1H3,(H,17,18)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536145
PNG
(CHEMBL4588236)
Show SMILES Cc1c(C(O)=O)c(=O)c(O)cn1-c1ccccc1
Show InChI InChI=1S/C13H11NO4/c1-8-11(13(17)18)12(16)10(15)7-14(8)9-5-3-2-4-6-9/h2-7,15H,1H3,(H,17,18)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536136
PNG
(CHEMBL4566537)
Show SMILES Cc1cc(=O)c(O)cn1C1CCOCC1
Show InChI InChI=1S/C11H15NO3/c1-8-6-10(13)11(14)7-12(8)9-2-4-15-5-3-9/h6-7,9,14H,2-5H2,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536152
PNG
(CHEMBL4564718)
Show SMILES Cc1cc(=O)c(O)cn1-c1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C18H15NO3/c1-13-10-17(20)18(21)12-19(13)14-6-5-9-16(11-14)22-15-7-3-2-4-8-15/h2-12,21H,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536154
PNG
(CHEMBL4534691)
Show SMILES CNS(=O)(=O)c1ccc(cc1)-n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C13H14N2O4S/c1-9-7-12(16)13(17)8-15(9)10-3-5-11(6-4-10)20(18,19)14-2/h3-8,14,17H,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536152
PNG
(CHEMBL4564718)
Show SMILES Cc1cc(=O)c(O)cn1-c1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C18H15NO3/c1-13-10-17(20)18(21)12-19(13)14-6-5-9-16(11-14)22-15-7-3-2-4-8-15/h2-12,21H,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536136
PNG
(CHEMBL4566537)
Show SMILES Cc1cc(=O)c(O)cn1C1CCOCC1
Show InChI InChI=1S/C11H15NO3/c1-8-6-10(13)11(14)7-12(8)9-2-4-15-5-3-9/h6-7,9,14H,2-5H2,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536154
PNG
(CHEMBL4534691)
Show SMILES CNS(=O)(=O)c1ccc(cc1)-n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C13H14N2O4S/c1-9-7-12(16)13(17)8-15(9)10-3-5-11(6-4-10)20(18,19)14-2/h3-8,14,17H,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536129
PNG
(CHEMBL4537957)
Show SMILES CN(Cc1cc(=O)c(O)co1)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H12ClNO3/c1-15(10-4-2-9(14)3-5-10)7-11-6-12(16)13(17)8-18-11/h2-6,8,17H,7H2,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536129
PNG
(CHEMBL4537957)
Show SMILES CN(Cc1cc(=O)c(O)co1)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H12ClNO3/c1-15(10-4-2-9(14)3-5-10)7-11-6-12(16)13(17)8-18-11/h2-6,8,17H,7H2,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536130
PNG
(CHEMBL4532507)
Show SMILES CN(Cc1cc(=O)c(O)co1)c1cccc(Cl)c1
Show InChI InChI=1S/C13H12ClNO3/c1-15(10-4-2-3-9(14)5-10)7-11-6-12(16)13(17)8-18-11/h2-6,8,17H,7H2,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536137
PNG
(CHEMBL4574525)
Show SMILES Cc1cc(=O)c(O)cn1C1CCN(CC1)S(C)(=O)=O
Show InChI InChI=1S/C12H18N2O4S/c1-9-7-11(15)12(16)8-14(9)10-3-5-13(6-4-10)19(2,17)18/h7-8,10,16H,3-6H2,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536130
PNG
(CHEMBL4532507)
Show SMILES CN(Cc1cc(=O)c(O)co1)c1cccc(Cl)c1
Show InChI InChI=1S/C13H12ClNO3/c1-15(10-4-2-3-9(14)5-10)7-11-6-12(16)13(17)8-18-11/h2-6,8,17H,7H2,1H3
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n/an/a 1.10E+3n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536137
PNG
(CHEMBL4574525)
Show SMILES Cc1cc(=O)c(O)cn1C1CCN(CC1)S(C)(=O)=O
Show InChI InChI=1S/C12H18N2O4S/c1-9-7-11(15)12(16)8-14(9)10-3-5-13(6-4-10)19(2,17)18/h7-8,10,16H,3-6H2,1-2H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536150
PNG
(CHEMBL4544589)
Show SMILES Cc1cc(=O)c(O)cn1-c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H15NO2/c1-13-11-17(20)18(21)12-19(13)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-12,21H,1H3
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n/an/a 1.26E+3n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536150
PNG
(CHEMBL4544589)
Show SMILES Cc1cc(=O)c(O)cn1-c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H15NO2/c1-13-11-17(20)18(21)12-19(13)16-9-7-15(8-10-16)14-5-3-2-4-6-14/h2-12,21H,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536123
PNG
(CHEMBL4540636)
Show SMILES Cc1occ(O)c(=O)c1C(=O)NCCc1c[nH]c2ccccc12
Show InChI InChI=1S/C17H16N2O4/c1-10-15(16(21)14(20)9-23-10)17(22)18-7-6-11-8-19-13-5-3-2-4-12(11)13/h2-5,8-9,19-20H,6-7H2,1H3,(H,18,22)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536123
PNG
(CHEMBL4540636)
Show SMILES Cc1occ(O)c(=O)c1C(=O)NCCc1c[nH]c2ccccc12
Show InChI InChI=1S/C17H16N2O4/c1-10-15(16(21)14(20)9-23-10)17(22)18-7-6-11-8-19-13-5-3-2-4-12(11)13/h2-5,8-9,19-20H,6-7H2,1H3,(H,18,22)
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536148
PNG
(CHEMBL4590431)
Show SMILES Oc1coc(CNS(=O)(=O)c2ccccc2)cc1=O
Show InChI InChI=1S/C12H11NO5S/c14-11-6-9(18-8-12(11)15)7-13-19(16,17)10-4-2-1-3-5-10/h1-6,8,13,15H,7H2
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536148
PNG
(CHEMBL4590431)
Show SMILES Oc1coc(CNS(=O)(=O)c2ccccc2)cc1=O
Show InChI InChI=1S/C12H11NO5S/c14-11-6-9(18-8-12(11)15)7-13-19(16,17)10-4-2-1-3-5-10/h1-6,8,13,15H,7H2
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n/an/a 1.70E+3n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536131
PNG
(CHEMBL4531893)
Show SMILES CN(Cc1cc(=O)c(O)co1)c1ccc(F)cc1
Show InChI InChI=1S/C13H12FNO3/c1-15(10-4-2-9(14)3-5-10)7-11-6-12(16)13(17)8-18-11/h2-6,8,17H,7H2,1H3
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University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536131
PNG
(CHEMBL4531893)
Show SMILES CN(Cc1cc(=O)c(O)co1)c1ccc(F)cc1
Show InChI InChI=1S/C13H12FNO3/c1-15(10-4-2-9(14)3-5-10)7-11-6-12(16)13(17)8-18-11/h2-6,8,17H,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.80E+3n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536160
PNG
(CHEMBL4583580)
Show SMILES CN1CCC(CC1)n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C12H18N2O2/c1-9-7-11(15)12(16)8-14(9)10-3-5-13(2)6-4-10/h7-8,10,16H,3-6H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536159
PNG
(CHEMBL4545797)
Show SMILES COc1cccc(c1)N(C)Cc1cc(=O)c(O)co1
Show InChI InChI=1S/C14H15NO4/c1-15(10-4-3-5-11(6-10)18-2)8-12-7-13(16)14(17)9-19-12/h3-7,9,17H,8H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536133
PNG
(CHEMBL4586558)
Show SMILES CC(C)n1cc(O)c(=O)cc1C
Show InChI InChI=1S/C9H13NO2/c1-6(2)10-5-9(12)8(11)4-7(10)3/h4-6,12H,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
Polymerase acidic protein


(Hepatitis C virus)
BDBM50536159
PNG
(CHEMBL4545797)
Show SMILES COc1cccc(c1)N(C)Cc1cc(=O)c(O)co1
Show InChI InChI=1S/C14H15NO4/c1-15(10-4-3-5-11(6-10)18-2)8-12-7-13(16)14(17)9-19-12/h3-7,9,17H,8H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.20E+3n/an/an/an/an/an/a



University of California San Diego

Curated by ChEMBL


Assay Description
Inhibition of 8-histidine tagged influenza virus H1N1 N-terminal PA endonuclease expressed in Escherichia coli BL21 cells using single-stranded 5'-FA...


J Med Chem 59: 6444-54 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00628
BindingDB Entry DOI: 10.7270/Q2W95DPM
More data for this
Ligand-Target Pair
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