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PubMed code 27474803

Compile data set for download or QSAR
Found 20 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
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193765
PNG
((E)-5-((2-(quinoxalin-2-yl)hydrazono)methyl)benzen...)
Show SMILES Oc1cc(O)c(\C=N\Nc2cnc3ccccc3n2)cc1O
Show InChI InChI=1S/C15H12N4O3/c20-12-6-14(22)13(21)5-9(12)7-17-19-15-8-16-10-3-1-2-4-11(10)18-15/h1-8,20-22H,(H,18,19)/b17-7+
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n/an/a 3.20E+3n/an/an/an/an/an/a



Universiti Teknologi MARA (UiTM)



Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193764
PNG
((E)-4-((2-(quinoxalin-2-yl)hydrazono)methyl)benzen...)
Show SMILES Oc1ccc(\C=N\Nc2cnc3ccccc3n2)cc1O
Show InChI InChI=1S/C15H12N4O2/c20-13-6-5-10(7-14(13)21)8-17-19-15-9-16-11-3-1-2-4-12(11)18-15/h1-9,20-21H,(H,18,19)/b17-8+
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n/an/a 8.60E+3n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193766
PNG
((E)-5-((2-(quinoxalin-2-yl)hydrazono)methyl)benzen...)
Show SMILES Oc1cc(O)c(\C=N\Nc2cnc3ccccc3n2)c(O)c1
Show InChI InChI=1S/C15H12N4O3/c20-9-5-13(21)10(14(22)6-9)7-17-19-15-8-16-11-3-1-2-4-12(11)18-15/h1-8,20-22H,(H,18,19)/b17-7+
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n/an/a 9.10E+3n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193761
PNG
((E)-3-((2-(quinoxalin-2-yl)hydrazono)methyl)benzen...)
Show SMILES Oc1cccc(\C=N\Nc2cnc3ccccc3n2)c1O
Show InChI InChI=1S/C15H12N4O2/c20-13-7-3-4-10(15(13)21)8-17-19-14-9-16-11-5-1-2-6-12(11)18-14/h1-9,20-21H,(H,18,19)/b17-8+
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n/an/a 1.54E+4n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193762
PNG
((E)-4-((2-(quinoxalin-2-yl)hydrazono)methyl)benzen...)
Show SMILES Oc1ccc(\C=N\Nc2cnc3ccccc3n2)c(O)c1
Show InChI InChI=1S/C15H12N4O2/c20-11-6-5-10(14(21)7-11)8-17-19-15-9-16-12-3-1-2-4-13(12)18-15/h1-9,20-21H,(H,18,19)/b17-8+
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n/an/a 3.34E+4n/an/an/an/an/an/a



Universiti Teknologi MARA (UiTM)



Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193748
PNG
((E)-2-(2-(2-fluorobenzylidene)hydrazinyl)quinoxali...)
Show SMILES Fc1ccccc1\C=N\Nc1cnc2ccccc2n1
Show InChI InChI=1S/C15H11FN4/c16-12-6-2-1-5-11(12)9-18-20-15-10-17-13-7-3-4-8-14(13)19-15/h1-10H,(H,19,20)/b18-9+
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n/an/a 3.36E+4n/an/an/an/an/an/a



Universiti Teknologi MARA (UiTM)



Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193767
PNG
((E)-5-methoxy-2-((2-(quinoxalin-2-yl)hydrazono)met...)
Show SMILES COc1ccc(\C=N\Nc2cnc3ccccc3n2)c(O)c1
Show InChI InChI=1S/C16H14N4O2/c1-22-12-7-6-11(15(21)8-12)9-18-20-16-10-17-13-4-2-3-5-14(13)19-16/h2-10,21H,1H3,(H,19,20)/b18-9+
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n/an/a 3.44E+4n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193763
PNG
((E)-2-((2-(quinoxalin-2-yl)hydrazono)methyl)benzen...)
Show SMILES Oc1ccc(O)c(\C=N\Nc2cnc3ccccc3n2)c1
Show InChI InChI=1S/C15H12N4O2/c20-11-5-6-14(21)10(7-11)8-17-19-15-9-16-12-3-1-2-4-13(12)18-15/h1-9,20-21H,(H,18,19)/b17-8+
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n/an/a 3.55E+4n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193771
PNG
((E)-4-methoxy-2-((2-(quinoxalin-2-yl)hydrazono)met...)
Show SMILES COc1ccc(O)c(\C=N\Nc2cnc3ccccc3n2)c1
Show InChI InChI=1S/C16H14N4O2/c1-22-12-6-7-15(21)11(8-12)9-18-20-16-10-17-13-4-2-3-5-14(13)19-16/h2-10,21H,1H3,(H,19,20)/b18-9+
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n/an/a 3.63E+4n/an/an/an/an/an/a



Universiti Teknologi MARA (UiTM)



Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193775
PNG
((E)-2-((2-(quinoxalin-2-yl)hydrazono)methyl)phenol...)
Show SMILES Oc1ccccc1\C=N\Nc1cnc2ccccc2n1
Show InChI InChI=1S/C15H12N4O/c20-14-8-4-1-5-11(14)9-17-19-15-10-16-12-6-2-3-7-13(12)18-15/h1-10,20H,(H,18,19)/b17-9+
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n/an/a 3.72E+4n/an/an/an/an/an/a



Universiti Teknologi MARA (UiTM)



Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193751
PNG
((E)-2-(2-(2-chlorobenzylidene)hydrazinyl)quinoxali...)
Show SMILES Clc1ccccc1\C=N\Nc1cnc2ccccc2n1
Show InChI InChI=1S/C15H11ClN4/c16-12-6-2-1-5-11(12)9-18-20-15-10-17-13-7-3-4-8-14(13)19-15/h1-10H,(H,19,20)/b18-9+
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n/an/a 3.76E+4n/an/an/an/an/an/a



Universiti Teknologi MARA (UiTM)



Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM50134399
PNG
(1,7-Dihydro-pyrrolo[2,3-d]pyrimidine-2,4-dione | 7...)
Show SMILES O=c1[nH]c2[nH]ccc2c(=O)[nH]1
Show InChI InChI=1S/C6H5N3O2/c10-5-3-1-2-7-4(3)8-6(11)9-5/h1-2H,(H3,7,8,9,10,11)
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n/an/a 3.87E+4n/an/an/an/an/an/a



Universiti Teknologi MARA (UiTM)



Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193768
PNG
((E)-2-methoxy-5-((2-(quinoxalin-2-yl)hydrazono)met...)
Show SMILES COc1ccc(\C=N\Nc2cnc3ccccc3n2)cc1O
Show InChI InChI=1S/C16H14N4O2/c1-22-15-7-6-11(8-14(15)21)9-18-20-16-10-17-12-4-2-3-5-13(12)19-16/h2-10,21H,1H3,(H,19,20)/b18-9+
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n/an/a 4.69E+4n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193760
PNG
((E)-4-((2-(quinoxalin-2-yl)hydrazono)methyl)phenol...)
Show SMILES Oc1ccc(\C=N\Nc2cnc3ccccc3n2)cc1
Show InChI InChI=1S/C15H12N4O/c20-12-7-5-11(6-8-12)9-17-19-15-10-16-13-3-1-2-4-14(13)18-15/h1-10,20H,(H,18,19)/b17-9+
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n/an/a 4.86E+4n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193750
PNG
((E)-2-(2-(4-fluorobenzylidene)hydrazinyl)quinoxali...)
Show SMILES Fc1ccc(\C=N\Nc2cnc3ccccc3n2)cc1
Show InChI InChI=1S/C15H11FN4/c16-12-7-5-11(6-8-12)9-18-20-15-10-17-13-3-1-2-4-14(13)19-15/h1-10H,(H,19,20)/b18-9+
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n/an/a 5.81E+4n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193759
PNG
((E)-3-((2-(quinoxalin-2-yl)hydrazono)methyl)phenol...)
Show SMILES Oc1cccc(\C=N\Nc2cnc3ccccc3n2)c1
Show InChI InChI=1S/C15H12N4O/c20-12-5-3-4-11(8-12)9-17-19-15-10-16-13-6-1-2-7-14(13)18-15/h1-10,20H,(H,18,19)/b17-9+
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n/an/a 6.32E+4n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193749
PNG
((E)-2-(2-(3-fluorobenzylidene)hydrazinyl)quinoxali...)
Show SMILES Fc1cccc(\C=N\Nc2cnc3ccccc3n2)c1
Show InChI InChI=1S/C15H11FN4/c16-12-5-3-4-11(8-12)9-18-20-15-10-17-13-6-1-2-7-14(13)19-15/h1-10H,(H,19,20)/b18-9+
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n/an/a 6.61E+4n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM60930
PNG
((E)-2-(2-(3-chlorobenzylidene)hydrazinyl)quinoxali...)
Show SMILES Clc1ccc(\C=N\Nc2cnc3ccccc3n2)cc1
Show InChI InChI=1S/C15H11ClN4/c16-12-7-5-11(6-8-12)9-18-20-15-10-17-13-3-1-2-4-14(13)19-15/h1-10H,(H,19,20)/b18-9+
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n/an/a 7.34E+4n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193774
PNG
((E)-2-(2-((1H-indol-3-yl)methylene)hydrazinyl)quin...)
Show SMILES N(\N=C\c1c[nH]c2ccccc12)c1cnc2ccccc2n1
Show InChI InChI=1S/C17H13N5/c1-2-6-14-13(5-1)12(9-18-14)10-20-22-17-11-19-15-7-3-4-8-16(15)21-17/h1-11,18H,(H,21,22)/b20-10+
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n/an/a 8.43E+4n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
Thymidine phosphorylase (TP)


(Escherichia coli (Enterobacteria))
BDBM193752
PNG
((E)-2-(2-(3-chlorobenzylidene)hydrazinyl)quinoxali...)
Show SMILES Clc1cccc(\C=N\Nc2cnc3ccccc3n2)c1
Show InChI InChI=1S/C15H11ClN4/c16-12-5-3-4-11(8-12)9-18-20-15-10-17-13-6-1-2-7-14(13)19-15/h1-10H,(H,19,20)/b18-9+
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n/an/a 9.35E+4n/an/an/an/an/an/a



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Assay Description
The Thymidine phosphorylase/PD-ECGF (E. coli) activity was determined by measuring the absorbance at 290 nm spectrophotometrically. In brief, total r...


Bioorg Chem 68: 80-89 (2016)


Article DOI: 10.1016/j.bioorg.2016.07.010
BindingDB Entry DOI: 10.7270/Q2H9940F
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%