Detailed information for compound 727513

Basic information

Technical information
  • TDR Targets ID: 727513
  • Name: N,N-diethyl-1-[[4-(trifluoromethyl)phenyl]met hyl]piperidine-3-carboxamide
  • MW: 342.399 | Formula: C18H25F3N2O
  • H donors: 0 H acceptors: 1 LogP: 3.33 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(C(=O)C1CCCN(C1)Cc1ccc(cc1)C(F)(F)F)CC
  • InChi: 1S/C18H25F3N2O/c1-3-23(4-2)17(24)15-6-5-11-22(13-15)12-14-7-9-16(10-8-14)18(19,20)21/h7-10,15H,3-6,11-13H2,1-2H3
  • InChiKey: VSOILJKNYROKOQ-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • N,N-diethyl-1-[[4-(trifluoromethyl)phenyl]methyl]-3-piperidinecarboxamide
  • N,N-diethyl-1-[4-(trifluoromethyl)benzyl]nipecotamide

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
Echinococcus multilocularis hexokinase 0.0395 1 1
Toxoplasma gondii hexokinase 0.0395 1 1
Giardia lamblia Glucose-6-phosphate 1-dehydrogenase 0.0234 0.5103 1
Trypanosoma brucei hexokinase 0.0395 1 1
Brugia malayi Hexokinase family protein 0.0395 1 1
Trypanosoma cruzi hexokinase, putative 0.0395 1 1
Trypanosoma cruzi polo-like protein kinase, putative 0.0098 0.0968 0.0785
Brugia malayi MH2 domain containing protein 0.0124 0.1752 0.0868
Loa Loa (eye worm) transcription factor SMAD2 0.0124 0.1752 0.0868
Brugia malayi glucose-6-phosphate dehydrogenase 0.0225 0.4842 0.4289
Brugia malayi Hexokinase family protein 0.0122 0.171 0.0822
Trypanosoma brucei hypothetical protein, conserved 0.022 0.4689 0.4689
Onchocerca volvulus Hexokinase homolog 0.0248 0.5527 0.5047
Echinococcus multilocularis hexokinase 0.0395 1 1
Loa Loa (eye worm) hexokinase 0.0395 1 1
Echinococcus granulosus hexokinase 0.0395 1 1
Trichomonas vaginalis 6-phosphogluconolactonase, putative 0.0234 0.5103 0.7346
Trichomonas vaginalis glutaminase, putative 0.0283 0.6597 1
Schistosoma mansoni hexokinase 0.0395 1 1
Loa Loa (eye worm) hypothetical protein 0.0269 0.6183 0.5774
Onchocerca volvulus 0.0395 1 1
Plasmodium falciparum glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase 0.0234 0.5103 0.0506
Treponema pallidum hexokinase (hxk) 0.0395 1 1
Mycobacterium tuberculosis Class a beta-lactamase BlaC 0.0137 0.2171 1
Leishmania major hypothetical protein, conserved 0.022 0.4689 0.412
Chlamydia trachomatis glucose-6-phosphate 1-dehydrogenase 0.0225 0.4842 0.5
Trypanosoma cruzi hexokinase, putative 0.0395 1 1
Brugia malayi hexokinase type II 0.0126 0.1812 0.0935
Echinococcus multilocularis glucose 6 phosphate 1 dehydrogenase 0.0225 0.4842 0.4289
Mycobacterium ulcerans glutaminase 0.0283 0.6597 1
Plasmodium falciparum hexokinase 0.0395 1 1
Echinococcus granulosus hexokinase type 2 0.0395 1 1
Entamoeba histolytica hexokinase 1 0.0395 1 1
Echinococcus granulosus hexokinase 0.0395 1 1
Mycobacterium tuberculosis Probable glucose-6-phosphate 1-dehydrogenase Zwf2 (G6PD) 0.0078 0.0371 0.1707
Loa Loa (eye worm) hexokinase 0.0395 1 1
Leishmania major glucose-6-phosphate 1-dehydrogenase, putative 0.0225 0.4842 0.4289
Leishmania major hexokinase, putative 0.0395 1 1
Leishmania major hexokinase, putative 0.0395 1 1
Echinococcus granulosus glucose 6 phosphate 1 dehydrogenase 0.0225 0.4842 0.4289
Trypanosoma brucei glucose-6-phosphate 1-dehydrogenase 0.0225 0.4842 0.4842
Loa Loa (eye worm) hexokinase type II 0.0395 1 1
Trypanosoma cruzi glucose-6-phosphate 1-dehydrogenase, putative 0.0225 0.4842 0.4737
Trypanosoma brucei polo-like protein kinase 0.0098 0.0968 0.0968
Echinococcus multilocularis hexokinase type 2 0.0395 1 1
Trypanosoma cruzi hypothetical protein, conserved 0.022 0.4689 0.4582
Plasmodium vivax hexokinase, putative 0.0395 1 1
Loa Loa (eye worm) glutaminase 0.0283 0.6597 0.6232
Brugia malayi Hexokinase family protein 0.0248 0.5527 0.5047
Loa Loa (eye worm) glucose-6-phosphate dehydrogenase 0.0225 0.4842 0.4289
Onchocerca volvulus 0.0248 0.5527 0.5047
Trypanosoma cruzi hypothetical protein, conserved 0.022 0.4689 0.4582
Schistosoma mansoni glucose-6-phosphate 1-dehydrogenase 0.0225 0.4842 0.4289
Onchocerca volvulus 0.0395 1 1
Echinococcus multilocularis hexokinase 0.0395 1 1
Trypanosoma brucei hexokinase 0.0395 1 1
Mycobacterium leprae PROBABLE CONSERVED LIPOPROTEIN LPQF 0.0066 0 0.5
Loa Loa (eye worm) hexokinase 0.0248 0.5527 0.5047
Schistosoma mansoni glutaminase 0.0283 0.6597 0.6232
Mycobacterium ulcerans class a beta-lactamase, BlaC 0.0137 0.2171 0.3291
Mycobacterium ulcerans glucose-6-phosphate 1-dehydrogenase 0.0225 0.4842 0.734
Loa Loa (eye worm) glutaminase 2 0.0283 0.6597 0.6232
Onchocerca volvulus 0.0395 1 1
Trypanosoma cruzi polo-like protein kinase, putative 0.0098 0.0968 0.0785
Mycobacterium ulcerans glucose-6-phosphate 1-dehydrogenase 0.0147 0.2467 0.374
Loa Loa (eye worm) hypothetical protein 0.0126 0.1812 0.0935
Loa Loa (eye worm) hypothetical protein 0.0126 0.1812 0.0935
Trypanosoma brucei hexokinase, putative 0.0395 1 1
Toxoplasma gondii glucose-6-phosphate 1-dehydrogenase 0.0234 0.5103 0.3499
Loa Loa (eye worm) MH2 domain-containing protein 0.0124 0.1752 0.0868
Loa Loa (eye worm) hexokinase 0.0122 0.171 0.0822
Trichomonas vaginalis glucosamine-6-phosphate isomerase, putative 0.0234 0.5103 0.7346
Trypanosoma cruzi glucose-6-phosphate 1-dehydrogenase, putative 0.0075 0.0264 0.0067
Brugia malayi glutaminase DH11.1 0.0283 0.6597 0.6232
Trichomonas vaginalis glucosamine-6-phosphate isomerase, putative 0.0234 0.5103 0.7346
Entamoeba histolytica hexokinase 2 0.0395 1 1
Echinococcus granulosus hexokinase 0.0395 1 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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