Detailed information for compound 897365

Basic information

Technical information
  • TDR Targets ID: 897365
  • Name: 4-chloro-N-(4-methoxy-2-nitrophenyl)-3-nitrob enzamide
  • MW: 351.699 | Formula: C14H10ClN3O6
  • H donors: 1 H acceptors: 5 LogP: 3.57 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(c(c1)[N+](=O)[O-])NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl
  • InChi: 1S/C14H10ClN3O6/c1-24-9-3-5-11(13(7-9)18(22)23)16-14(19)8-2-4-10(15)12(6-8)17(20)21/h2-7H,1H3,(H,16,19)
  • InChiKey: XBCJWOZDLUHQIS-UHFFFAOYSA-N  

Network

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Synonyms

  • 4-Chloro-N-(4-methoxy-2-nitro-phenyl)-3-nitro-benzamide
  • Oprea1_509682
  • A0780/0036500
  • BAS 00342452
  • ZINC04412700

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
Brugia malayi Histone deacetylase family protein 0.0604 0.9751 1
Brugia malayi histone deacetylase 3 (HD3) 0.0548 0.8636 0.6226
Trichomonas vaginalis histone deacetylase, putative 0.0548 0.8636 0.5
Trichomonas vaginalis histone deacetylase, putative 0.0548 0.8636 0.5
Loa Loa (eye worm) hypothetical protein 0.0272 0.3135 0.2101
Trypanosoma brucei histone deacetylase 1 0.0548 0.8636 0.8315
Loa Loa (eye worm) hypothetical protein 0.0345 0.4578 0.3824
Echinococcus granulosus histone deacetylase 3 0.0548 0.8636 0.8636
Echinococcus granulosus histone deacetylase 6 0.0604 0.9751 0.9751
Toxoplasma gondii histone deacetylase HDAC1 0.0604 0.9751 1
Echinococcus granulosus histone deacetylase 8 0.0272 0.3135 0.3135
Loa Loa (eye worm) histone deacetylase 0.0604 0.9751 1
Brugia malayi histone deacetylase 1 (HD1) 0.0548 0.8636 0.6226
Trichomonas vaginalis histone deacetylase, putative 0.0548 0.8636 0.5
Trypanosoma cruzi histone deacetylase, putative 0.0604 0.9751 1
Echinococcus multilocularis histone deacetylase 7 0.0604 0.9751 0.9751
Echinococcus granulosus histone deacetylase 1 0.0548 0.8636 0.8636
Toxoplasma gondii histone deacetylase HDAC3 0.0548 0.8636 0.8315
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0548 0.8636 0.5
Echinococcus granulosus histone deacetylase 6 0.0604 0.9751 0.9751
Leishmania major histone deacetylase, putative 0.0604 0.9751 1
Loa Loa (eye worm) histone deacetylase 7A 0.0604 0.9751 1
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0548 0.8636 0.5
Schistosoma mansoni histone deacetylase 0.0548 0.8636 0.8636
Plasmodium vivax histone deacetylase 2, putative 0.0604 0.9751 1
Loa Loa (eye worm) histone deacetylase 3 0.0548 0.8636 0.8669
Leishmania major histone deacetylase, putative 0.0604 0.9751 1
Trypanosoma cruzi histone deacetylase, putative 0.0604 0.9751 1
Trypanosoma cruzi histone deacetylase 1, putative 0.0548 0.8636 0.8315
Loa Loa (eye worm) histone deacetylase 1 0.0548 0.8636 0.8669
Plasmodium vivax histone deacetylase, putative 0.0604 0.9751 1
Echinococcus multilocularis histone deacetylase 6 0.0617 1 1
Entamoeba histolytica histone deacetylase, putative 0.0548 0.8636 0.5
Echinococcus granulosus histone deacetylase 7 0.0604 0.9751 0.9751
Trichomonas vaginalis histone deacetylase 1, 2 ,3, putative 0.0548 0.8636 0.5
Trypanosoma cruzi histone deacetylase 1, putative 0.0548 0.8636 0.8315
Echinococcus multilocularis histone deacetylase 8 0.0272 0.3135 0.3135
Onchocerca volvulus Histone deacetylase 10 homolog 0.0272 0.3135 0.5
Loa Loa (eye worm) histone deacetylase 11 0.0456 0.6797 0.6473
Trichomonas vaginalis histone deacetylase, putative 0.0548 0.8636 0.5
Brugia malayi Histone deacetylase 1 0.0548 0.8636 0.6226
Toxoplasma gondii histone deacetylase HDAC4 0.0456 0.6797 0.5534
Trypanosoma brucei histone deacetylase 4 0.0604 0.9751 1
Trypanosoma brucei histone deacetylase 3 0.0604 0.9751 1
Schistosoma mansoni histone deacetylase hda2 0.0272 0.3135 0.3135
Trypanosoma cruzi histone deacetylase, putative 0.0604 0.9751 1
Echinococcus multilocularis histone deacetylase 6 0.0604 0.9751 0.9751
Echinococcus multilocularis histone deacetylase 1 0.0548 0.8636 0.8636
Plasmodium vivax histone deacetylase 1, putative 0.0548 0.8636 0.6226
Plasmodium falciparum histone deacetylase 2 0.0604 0.9751 1
Schistosoma mansoni histone deacetylase 4 5 0.0604 0.9751 0.9751
Echinococcus multilocularis histone deacetylase 6 0.0604 0.9751 0.9751
Plasmodium falciparum histone deacetylase, putative 0.0604 0.9751 1
Schistosoma mansoni histone deacetylase 0.0548 0.8636 0.8636
Brugia malayi Histone deacetylase family protein 0.0604 0.9751 1
Trichomonas vaginalis histone deacetylase, putative 0.0548 0.8636 0.5
Trypanosoma brucei histone deacetylase, putative 0.0604 0.9751 1
Schistosoma mansoni histone deacetylase 1 2 3 0.0272 0.3135 0.3135
Giardia lamblia Histone deacetylase 0.0548 0.8636 0.5
Echinococcus multilocularis histone deacetylase 3 0.0548 0.8636 0.8636
Toxoplasma gondii histone deacetylase HDAC2 0.0548 0.8636 0.8315
Schistosoma mansoni histone deacetylase hda2 0.0617 1 1
Trichomonas vaginalis histone deacetylase, putative 0.0548 0.8636 0.5
Loa Loa (eye worm) hypothetical protein 0.0548 0.8636 0.8669
Echinococcus granulosus histone deacetylase 0.0604 0.9751 0.9751
Schistosoma mansoni histone deacetylase 4 5 0.0604 0.9751 0.9751
Echinococcus multilocularis histone deacetylase 0.0604 0.9751 0.9751
Loa Loa (eye worm) hypothetical protein 0.0332 0.4329 0.3527

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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