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Compile Data Set for Download or QSAR

Found 6 hits with Last Name = 'voshol' and Initial = 'h'   
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
DNA polymerase (alpha/delta/epsilon)


(Homo sapiens (Human))
BDBM50300193
PNG
(2-[3-(1-Benzyl-1H-pyrazol-3-yl)-benzenesulfonylami...)
Show SMILES OC(=O)c1ccccc1NS(=O)(=O)c1cccc(c1)-c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C23H19N3O4S/c27-23(28)21-11-4-5-12-22(21)25-31(29,30)20-10-6-9-18(13-20)19-14-24-26(16-19)15-17-7-2-1-3-8-17/h1-14,16,25H,15H2,(H,27,28)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Novartis Institute for Tropical Diseases

Curated by ChEMBL


Assay Description
Inhibition of human DNA polymerase alpha


J Med Chem 52: 7934-7 (2009)


Article DOI: 10.1021/jm901044z
BindingDB Entry DOI: 10.7270/Q2M61K9Q
More data for this
Ligand-Target Pair
DNA polymerase (alpha/delta/epsilon)


(Homo sapiens (Human))
BDBM50300194
PNG
(2-[3-(1-Benzyl-1H-pyrazol-3-yl)-benzenesulfonylami...)
Show SMILES OC(=O)c1ccc(F)cc1NS(=O)(=O)c1cccc(c1)-c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C23H18FN3O4S/c24-19-9-10-21(23(28)29)22(12-19)26-32(30,31)20-8-4-7-17(11-20)18-13-25-27(15-18)14-16-5-2-1-3-6-16/h1-13,15,26H,14H2,(H,28,29)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Novartis Institute for Tropical Diseases

Curated by ChEMBL


Assay Description
Inhibition of human DNA polymerase alpha


J Med Chem 52: 7934-7 (2009)


Article DOI: 10.1021/jm901044z
BindingDB Entry DOI: 10.7270/Q2M61K9Q
More data for this
Ligand-Target Pair
DNA polymerase beta


(Homo sapiens (Human))
BDBM50300195
PNG
(4-Fluoro-2-[3-(1-naphthalen-2-ylmethyl-1H-pyrazol-...)
Show SMILES OC(=O)c1ccc(F)cc1NS(=O)(=O)c1cccc(c1)-c1cnn(Cc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C27H20FN3O4S/c28-23-10-11-25(27(32)33)26(14-23)30-36(34,35)24-7-3-6-21(13-24)22-15-29-31(17-22)16-18-8-9-19-4-1-2-5-20(19)12-18/h1-15,17,30H,16H2,(H,32,33)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Novartis Institute for Tropical Diseases

Curated by ChEMBL


Assay Description
Inhibition of human DNA polymerase beta


J Med Chem 52: 7934-7 (2009)


Article DOI: 10.1021/jm901044z
BindingDB Entry DOI: 10.7270/Q2M61K9Q
More data for this
Ligand-Target Pair
DNA polymerase beta


(Homo sapiens (Human))
BDBM50300193
PNG
(2-[3-(1-Benzyl-1H-pyrazol-3-yl)-benzenesulfonylami...)
Show SMILES OC(=O)c1ccccc1NS(=O)(=O)c1cccc(c1)-c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C23H19N3O4S/c27-23(28)21-11-4-5-12-22(21)25-31(29,30)20-10-6-9-18(13-20)19-14-24-26(16-19)15-17-7-2-1-3-8-17/h1-14,16,25H,15H2,(H,27,28)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Novartis Institute for Tropical Diseases

Curated by ChEMBL


Assay Description
Inhibition of human DNA polymerase beta


J Med Chem 52: 7934-7 (2009)


Article DOI: 10.1021/jm901044z
BindingDB Entry DOI: 10.7270/Q2M61K9Q
More data for this
Ligand-Target Pair
DNA polymerase beta


(Homo sapiens (Human))
BDBM50300194
PNG
(2-[3-(1-Benzyl-1H-pyrazol-3-yl)-benzenesulfonylami...)
Show SMILES OC(=O)c1ccc(F)cc1NS(=O)(=O)c1cccc(c1)-c1cnn(Cc2ccccc2)c1
Show InChI InChI=1S/C23H18FN3O4S/c24-19-9-10-21(23(28)29)22(12-19)26-32(30,31)20-8-4-7-17(11-20)18-13-25-27(15-18)14-16-5-2-1-3-6-16/h1-13,15,26H,14H2,(H,28,29)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Novartis Institute for Tropical Diseases

Curated by ChEMBL


Assay Description
Inhibition of human DNA polymerase beta


J Med Chem 52: 7934-7 (2009)


Article DOI: 10.1021/jm901044z
BindingDB Entry DOI: 10.7270/Q2M61K9Q
More data for this
Ligand-Target Pair
DNA polymerase (alpha/delta/epsilon)


(Homo sapiens (Human))
BDBM50300195
PNG
(4-Fluoro-2-[3-(1-naphthalen-2-ylmethyl-1H-pyrazol-...)
Show SMILES OC(=O)c1ccc(F)cc1NS(=O)(=O)c1cccc(c1)-c1cnn(Cc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C27H20FN3O4S/c28-23-10-11-25(27(32)33)26(14-23)30-36(34,35)24-7-3-6-21(13-24)22-15-29-31(17-22)16-18-8-9-19-4-1-2-5-20(19)12-18/h1-15,17,30H,16H2,(H,32,33)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Novartis Institute for Tropical Diseases

Curated by ChEMBL


Assay Description
Inhibition of human DNA polymerase alpha


J Med Chem 52: 7934-7 (2009)


Article DOI: 10.1021/jm901044z
BindingDB Entry DOI: 10.7270/Q2M61K9Q
More data for this
Ligand-Target Pair