Detailed information for compound 724999

Basic information

Technical information
  • TDR Targets ID: 724999
  • Name: N-tert-butyl-2-(4-phenylbutanoylamino)benzami de
  • MW: 338.443 | Formula: C21H26N2O2
  • H donors: 2 H acceptors: 2 LogP: 4.16 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccccc1C(=O)NC(C)(C)C)CCCc1ccccc1
  • InChi: 1S/C21H26N2O2/c1-21(2,3)23-20(25)17-13-7-8-14-18(17)22-19(24)15-9-12-16-10-5-4-6-11-16/h4-8,10-11,13-14H,9,12,15H2,1-3H3,(H,22,24)(H,23,25)
  • InChiKey: RCKPAPHIPVYHFG-UHFFFAOYSA-N  

Network

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Synonyms

  • N-tert-butyl-2-[(1-oxo-4-phenylbutyl)amino]benzamide
  • STK218039
  • ZINC04814334

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
Trypanosoma brucei carnitine O-palmitoyltransferase II, putative 0.0289 0.7602 1
Loa Loa (eye worm) carnitine O-palmitoyltransferase I isoform 0.011 0.1094 0.1094
Leishmania major carnitine palmitoyltransferase-like protein 0.0289 0.7602 0.7602
Leishmania major choline/Carnitine o-acyltransferase-like protein 0.0355 1 1
Trypanosoma brucei carnitine O-palmitoyltransferase II, putative 0.011 0.1094 0.1439
Echinococcus multilocularis carnitine O palmitoyltransferase 1, liver 0.0355 1 1
Brugia malayi Choline O-acetyltransferase 0.011 0.1094 0.1094
Trypanosoma brucei carnitine O-palmitoyltransferase, putative 0.011 0.1094 0.1439
Trypanosoma cruzi carnitine/choline acetyltransferase, putative 0.011 0.1094 0.1094
Echinococcus granulosus carnitine O palmitoyltransferase 1 liver 0.0355 1 1
Trypanosoma cruzi carnitine O-acetyltransferase, putative 0.011 0.1094 0.1094
Trypanosoma cruzi carnitine O-palmitoyltransferase II, putative 0.0289 0.7602 0.7602
Plasmodium falciparum ataxin-2 like protein, putative 0.008 0 0.5
Schistosoma mansoni choline o-acyltransferase 0.011 0.1094 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.1094 0.1094
Onchocerca volvulus 0.011 0.1094 0.5
Plasmodium falciparum ataxin-2 like protein, putative 0.008 0 0.5
Onchocerca volvulus 0.011 0.1094 0.5
Onchocerca volvulus 0.011 0.1094 0.5
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.1094 0.1094
Loa Loa (eye worm) hypothetical protein 0.011 0.1094 0.1094
Brugia malayi Choline/Carnitine o-acyltransferase family protein 0.0289 0.7602 0.7602
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.1094 0.1094
Trypanosoma brucei carnitine O-acetyltransferase, putative 0.011 0.1094 0.1439
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.1094 0.1094
Schistosoma mansoni choline o-acyltransferase 0.011 0.1094 0.5
Trypanosoma cruzi choline/carnitine O-acyltransferase, putative 0.0355 1 1
Loa Loa (eye worm) hypothetical protein 0.0355 1 1
Trypanosoma cruzi choline/carnitine O-acyltransferase, putative 0.0355 1 1
Loa Loa (eye worm) choline O-acetyltransferase 0.011 0.1094 0.1094
Trypanosoma cruzi carnitine/choline acetyltransferase, putative 0.011 0.1094 0.1094
Trypanosoma cruzi choline/carnitine O-acetyltransferase, putative 0.011 0.1094 0.1094
Brugia malayi Choline O-acetyltransferase 0.011 0.1094 0.1094
Onchocerca volvulus 0.011 0.1094 0.5
Echinococcus granulosus carnitine O palmitoyltransferase 2 0.0289 0.7602 0.7308
Trypanosoma cruzi choline/carnitine O-acyltransferase, putative 0.011 0.1094 0.1094
Toxoplasma gondii LsmAD domain-containing protein 0.008 0 0.5
Leishmania major carnitine/choline acetyltransferase, putative 0.011 0.1094 0.1094
Echinococcus multilocularis carnitine O palmitoyltransferase 2 0.0289 0.7602 0.7308
Trypanosoma brucei hypothetical protein, conserved 0.011 0.1094 0.1439
Loa Loa (eye worm) choline/Carnitine O-acyltransferase 0.0289 0.7602 0.7602
Plasmodium vivax ataxin-2 like protein, putative 0.008 0 0.5
Brugia malayi Choline/Carnitine o-acyltransferase family protein 0.011 0.1094 0.1094
Trypanosoma cruzi hypothetical protein, conserved 0.011 0.1094 0.1094

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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