Detailed information for compound 834214

Basic information

Technical information
  • TDR Targets ID: 834214
  • Name: 3-methyl-N-[[3-(4-methylphenyl)-1,2,4-oxadiaz ol-5-yl]methyl]-4-nitro-N-propan-2-ylbenzamid e
  • MW: 394.424 | Formula: C21H22N4O4
  • H donors: 0 H acceptors: 5 LogP: 4.15 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)c1noc(n1)CN(C(=O)c1ccc(c(c1)C)[N+](=O)[O-])C(C)C
  • InChi: 1S/C21H22N4O4/c1-13(2)24(21(26)17-9-10-18(25(27)28)15(4)11-17)12-19-22-20(23-29-19)16-7-5-14(3)6-8-16/h5-11,13H,12H2,1-4H3
  • InChiKey: KOSUWEWNVCOGKF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-isopropyl-3-methyl-N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-nitro-benzamide
  • N-isopropyl-3-methyl-N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-nitrobenzamide
  • 3-methyl-N-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-nitro-N-propan-2-yl-benzamide
  • STK266852

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
Loa Loa (eye worm) hypothetical protein 0.001 0.5896 0.5896
Schistosoma mansoni thyroid hormone receptor 0.001 0.5896 0.5
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.001 0.5896 0.5896
Brugia malayi Cytochrome P450 family protein 0.0012 1 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.5896 0.5
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.5896 0.5
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.5896 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.5896 0.5896
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.5896 0.5
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.5896 0.5
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.5896 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.5896 0.5896
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.5896 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.5896 0.5896
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.001 0.5896 0.5896
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.001 0.5896 0.5896
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.5896 0.5
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.5896 0.5
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.5896 0.5
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.5896 0.5
Trypanosoma brucei cytochrome P450, putative 0.0012 1 0.5
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.5896 0.5
Trypanosoma cruzi cytochrome P450, putative 0.0012 1 0.5
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.5896 0.5
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0012 1 0.5
Echinococcus granulosus FTZ F1 alpha 0.001 0.5896 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.5896 0.5896
Trypanosoma cruzi cytochrome P450, putative 0.0012 1 0.5
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.5896 0.5
Schistosoma mansoni thyroid hormone receptor 0.001 0.5896 0.5
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.5896 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.5896 0.5
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.5896 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.5896 0.5896
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.5896 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.001 0.5896 0.5896
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.5896 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.5896 0.5
Onchocerca volvulus Bile acid receptor homolog 0.001 0.5896 0.5
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.5896 0.5
Schistosoma mansoni coup transcription factor 0.001 0.5896 0.5
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.5896 0.5
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.5896 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.001 0.5896 0.5896
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.001 0.5896 0.5896
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.5896 0.5
Leishmania major cytochrome p450-like protein 0.0012 1 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.5896 0.5896
Loa Loa (eye worm) cytochrome P450 family protein 0.0012 1 1
Schistosoma mansoni nuclear hormone receptor 0.001 0.5896 0.5
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.5896 0.5
Loa Loa (eye worm) steroid hormone receptor 0.001 0.5896 0.5896
Loa Loa (eye worm) cytochrome P450 family protein 0.0012 1 1
Onchocerca volvulus 0.001 0.5896 0.5
Echinococcus multilocularis FTZ F1 alpha 0.001 0.5896 0.5
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.5896 0.5
Loa Loa (eye worm) hypothetical protein 0.001 0.5896 0.5896
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.5896 0.5
Loa Loa (eye worm) CYP4Cod1 0.0012 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.001 0.5896 0.5896

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.