Detailed information for compound 912366

Basic information

Technical information
  • TDR Targets ID: 912366
  • Name: 4-methyl-N-(4-methylpyridin-2-yl)-3-nitrobenz amide
  • MW: 271.271 | Formula: C14H13N3O3
  • H donors: 1 H acceptors: 4 LogP: 2.58 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccnc(c1)NC(=O)c1ccc(c(c1)[N+](=O)[O-])C
  • InChi: 1S/C14H13N3O3/c1-9-5-6-15-13(7-9)16-14(18)11-4-3-10(2)12(8-11)17(19)20/h3-8H,1-2H3,(H,15,16,18)
  • InChiKey: WAWDWPZVIGAEMR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-methyl-N-(4-methyl-2-pyridyl)-3-nitro-benzamide
  • 4-methyl-N-(4-methyl-2-pyridyl)-3-nitrobenzamide
  • 4-methyl-N-(4-methylpyridin-2-yl)-3-nitro-benzamide
  • EU-0000574
  • ZINC00240629
  • Oprea1_006725

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Onchocerca volvulus 0.1048 0.6317 1
Echinococcus granulosus neuropeptide s receptor 0.0926 0.5552 1
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0206 0.1046 0.0872
Loa Loa (eye worm) thrombospondin type 1 domain-containing protein 0.1048 0.6317 1
Brugia malayi hypothetical protein 0.0076 0.0235 0.0081
Entamoeba histolytica transcription factor BTF3, putative 0.0069 0.019 0.1086
Schistosoma mansoni hypothetical protein 0.0076 0.0235 0.0081
Leishmania major ethanolamine phosphotransferase, putative 0.0076 0.0235 0.0322
Echinococcus multilocularis ectonucleotide pyrophosphatase:phosphodiesterase 0.0485 0.2796 0.2656
Schistosoma mansoni ectonucleotide pyrophosphatase/phosphodiesterase 0.0485 0.2796 0.4258
Echinococcus multilocularis neuropeptide receptor A26 0.0926 0.5552 0.5466
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0319 0.1751 1
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0319 0.1751 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.014 0.0633 0.1105
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0206 0.1046 0.0872
Echinococcus multilocularis ectonucleotide pyrophosphatase:phosphodiesterase 0.0076 0.0235 0.0046
Schistosoma mansoni endonuclease related 0.0292 0.1583 0.2279
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0144 0.0658 0.0771
Echinococcus granulosus ectonucleotide 0.0409 0.2318 0.4152
Echinococcus multilocularis ectonucleotide pyrophosphatase:phosphodiesterase 0.0485 0.2796 0.2656
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0319 0.1751 1
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0103 0.0399 0.0213
Brugia malayi Thrombospondin type 1 domain containing protein 0.1048 0.6317 1
Treponema pallidum fructose-bisphosphate aldolase 0.0319 0.1751 0.5
Echinococcus granulosus ectonucleotide pyrophosphatase:phosphodiesterase 0.0485 0.2796 0.5016
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.0399 0.0349
Trichomonas vaginalis conserved hypothetical protein 0.0069 0.019 0.0972
Brugia malayi endonuclease G, mitochondrial precursor 0.0292 0.1583 0.2279
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0156 0.0731 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0069 0.019 0.0972
Loa Loa (eye worm) hypothetical protein 0.0485 0.2796 0.4258
Schistosoma mansoni ectonucleotide pyrophosphatase/phosphodiesterase 0.0485 0.2796 0.4258
Echinococcus granulosus ectonucleotide pyrophosphatase:phosphodiesterase 0.0485 0.2796 0.5016
Trypanosoma brucei endonuclease G, putative 0.0292 0.1583 1
Onchocerca volvulus 0.0485 0.2796 0.4211
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.0399 0.0349
Schistosoma mansoni transcription factor btf3 0.0069 0.019 0.0008
Echinococcus granulosus gpi ethanolamine phosphate transferase 3 0.0076 0.0235 0.0385
Loa Loa (eye worm) ICD-1 protein 0.0069 0.019 0.0008
Plasmodium falciparum basic transcription factor 3b, putative 0.0069 0.019 0.8092
Echinococcus granulosus neuropeptide receptor A26 0.0926 0.5552 1
Loa Loa (eye worm) hypothetical protein 0.0076 0.0235 0.0081
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0206 0.1046 0.6562
Loa Loa (eye worm) hypothetical protein 0.0206 0.1046 0.1404
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.0206 0.1046 0.5973
Echinococcus multilocularis Endonuclease G 0.0292 0.1583 0.1419
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0206 0.1046 0.1852
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0206 0.1046 0.1404
Echinococcus multilocularis ectonucleotide pyrophosphatase:phosphodiesterase 0.0485 0.2796 0.2656
Toxoplasma gondii DNA/RNA non-specific endonuclease 0.0292 0.1583 1
Echinococcus granulosus ectonucleotide pyrophosphatase:phosphodiesterase 0.0485 0.2796 0.5016
Giardia lamblia Fructose-bisphosphate aldolase 0.0319 0.1751 1
Leishmania major endonuclease G, putative 0.0292 0.1583 1
Schistosoma mansoni hypothetical protein 0.1048 0.6317 1
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0206 0.1046 0.1852
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0319 0.1751 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0319 0.1751 1
Schistosoma mansoni ectonucleotide pyrophosphatase/phosphodiesterase 0.0485 0.2796 0.4258
Echinococcus granulosus ectonucleotide pyrophosphatase:phosphodiesterase 0.0485 0.2796 0.5016
Entamoeba histolytica phosphatidylinositol-glycan biosynthesis class O protein, putative 0.0076 0.0235 0.1342
Entamoeba histolytica phosphatidylinositol-glycan biosynthesis class O protein, putative 0.0076 0.0235 0.1342
Echinococcus granulosus ectonucleotide pyrophosphatase:phosphodiesterase 0.0409 0.2318 0.4152
Brugia malayi acetyltransferase, GNAT family protein 0.0144 0.0658 0.0771
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0319 0.1751 1
Loa Loa (eye worm) hypothetical protein 0.0076 0.0235 0.0081
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0181 0.0889 0.0713
Schistosoma mansoni hypothetical protein 0.0185 0.0913 0.1187
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0156 0.0731 1
Echinococcus multilocularis gpi ethanolamine phosphate transferase 3 0.0076 0.0235 0.0046
Toxoplasma gondii NAC domain-containing protein 0.0069 0.019 0.1077
Trypanosoma brucei GPI ethanolamine phosphate transferase 3, putative 0.0076 0.0235 0.0322
Loa Loa (eye worm) hypothetical protein 0.0076 0.0235 0.0081
Loa Loa (eye worm) hypothetical protein 0.0409 0.2318 0.3478
Trypanosoma cruzi DNA/RNA non-specific endonuclease protein-like, putative 0.0292 0.1583 1
Schistosoma mansoni hypothetical protein 0.0185 0.0913 0.1187
Trichomonas vaginalis conserved hypothetical protein 0.0069 0.019 0.0972
Loa Loa (eye worm) hypothetical protein 0.0485 0.2796 0.4258
Schistosoma mansoni hypothetical protein 0.0076 0.0235 0.0081
Trypanosoma brucei endonuclease G, putative 0.0292 0.1583 1
Loa Loa (eye worm) hypothetical protein 0.0076 0.0235 0.0081
Echinococcus multilocularis ectonucleotide pyrophosphatase:phosphodiesterase 0.0485 0.2796 0.2656
Toxoplasma gondii melibiase subfamily protein 0.0103 0.0399 0.2417
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0319 0.1751 1
Echinococcus multilocularis geminin 0.0185 0.0913 0.0737
Plasmodium vivax basic transcription factor 3b, putative 0.0069 0.019 1
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0068 0.0185 0.0944
Echinococcus multilocularis ectonucleotide pyrophosphatase:phosphodiesterase 0.0076 0.0235 0.0046
Loa Loa (eye worm) cyclic AMP specific phosphodiesterase PDE4D5A 0.0181 0.0889 0.1148
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0181 0.0889 0.1568
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0319 0.1751 1
Loa Loa (eye worm) hypothetical protein 0.0155 0.0726 0.0882
Brugia malayi AEL166Cp 0.0076 0.0235 0.0081
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.0399 0.0349
Plasmodium falciparum GPI ethanolamine phosphate transferase 3, putative 0.0076 0.0235 1
Schistosoma mansoni ectonucleotide pyrophosphatase/phosphodiesterase 0.0485 0.2796 0.4258
Echinococcus multilocularis neuropeptide s receptor 0.0926 0.5552 0.5466
Echinococcus multilocularis Alkaline phosphatase, core domain 0.0076 0.0235 0.0046
Trypanosoma cruzi endonuclease G, putative 0.0292 0.1583 1
Onchocerca volvulus 0.0155 0.0726 0.0808
Echinococcus multilocularis ectonucleotide pyrophosphatase:phosphodiesterase 0.0409 0.2318 0.2169
Brugia malayi hypothetical protein 0.0076 0.0235 0.0081
Echinococcus granulosus Endonuclease G 0.0292 0.1583 0.2822
Echinococcus granulosus geminin 0.0185 0.0913 0.1612
Trypanosoma cruzi DNA/RNA non-specific endonuclease protein-like, putative 0.0292 0.1583 1
Schistosoma mansoni ectonucleotide pyrophosphatase/phosphodiesterase 0.0076 0.0235 0.0081
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0144 0.0658 0.0477
Onchocerca volvulus 0.0485 0.2796 0.4211
Entamoeba histolytica hypothetical protein 0.0069 0.019 0.1086
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0103 0.0399 0.0213
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0319 0.1751 1
Giardia lamblia Phosphatidylinositol-glycan biosynthesis, class O protein 0.0076 0.0235 0.1342
Brugia malayi Type I phosphodiesterase / nucleotide pyrophosphatase family protein 0.0076 0.0235 0.0081
Echinococcus granulosus ectonucleotide pyrophosphatase:phosphodiesterase 0.0485 0.2796 0.5016
Brugia malayi beta-NAC-like protein 0.0069 0.019 0.0008
Echinococcus granulosus transferase 0.0076 0.0235 0.0385
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0319 0.1751 1
Loa Loa (eye worm) type I phosphodiesterase/nucleotide pyrophosphatase 0.0076 0.0235 0.0081
Schistosoma mansoni hypothetical protein 0.0076 0.0235 0.0081
Trypanosoma cruzi endonuclease G, putative 0.0292 0.1583 1
Loa Loa (eye worm) acetyltransferase 0.0144 0.0658 0.0771
Echinococcus multilocularis ectonucleotide pyrophosphatase:phosphodiesterase 0.0485 0.2796 0.2656
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0156 0.0731 1
Echinococcus granulosus ectonucleotide pyrophosphatase:phosphodiesterase 0.0076 0.0235 0.0385
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0181 0.0889 0.1148
Trypanosoma brucei endonuclease G, putative 0.0292 0.1583 1
Echinococcus multilocularis ectonucleotide 0.0409 0.2318 0.2169
Schistosoma mansoni hypothetical protein 0.0076 0.0235 0.0081
Brugia malayi Type I phosphodiesterase / nucleotide pyrophosphatase family protein 0.0485 0.2796 0.4258
Echinococcus multilocularis gpi ethanolamine phosphate transferase 1 0.0076 0.0235 0.0046
Loa Loa (eye worm) hypothetical protein 0.0485 0.2796 0.4258
Echinococcus granulosus transcription factor btf3 0.0069 0.019 0.0304
Echinococcus multilocularis transferase 0.0076 0.0235 0.0046
Brugia malayi hypothetical protein 0.0155 0.0726 0.0882
Echinococcus multilocularis ectonucleotide pyrophosphatase:phosphodiesterase 0.0485 0.2796 0.2656
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.0399 0.0349
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0103 0.0399 0.0682
Leishmania major DNA/RNA non-specific endonuclease-like protein 0.0292 0.1583 1

Activities

No activities found for this compound.

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

No literature references available for this target.

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