Detailed information for compound 660966

Basic information

Technical information
  • TDR Targets ID: 660966
  • Name: 1-[4-(2-chloro-4-methylphenoxy)butyl]-3-methy lpiperidine
  • MW: 295.847 | Formula: C17H26ClNO
  • H donors: 0 H acceptors: 0 LogP: 4.92 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC1CCCN(C1)CCCCOc1ccc(cc1Cl)C
  • InChi: 1S/C17H26ClNO/c1-14-7-8-17(16(18)12-14)20-11-4-3-9-19-10-5-6-15(2)13-19/h7-8,12,15H,3-6,9-11,13H2,1-2H3
  • InChiKey: QMVCCKPFOMOORM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-[4-(2-chloro-4-methyl-phenoxy)butyl]-3-methyl-piperidine

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 Neuropeptide F receptor homolog 0.0039 0 0.5
Schistosoma mansoni transcription factor LCR-F1 0.004 0.0006 0.0006
Schistosoma mansoni farnesyl pyrophosphate synthase 0.0099 0.4828 0.4828
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0039 0 0.5
Onchocerca volvulus 0.0039 0 0.5
Onchocerca volvulus 0.0039 0 0.5
Entamoeba histolytica hypothetical protein 0.004 0.0006 0.5
Trichomonas vaginalis geranylgeranyl diphosphate synthase, putative 0.0099 0.4828 0.5
Onchocerca volvulus 0.0039 0 0.5
Onchocerca volvulus 0.0039 0 0.5
Mycobacterium ulcerans geranylgeranyl pyrophosphate synthase 0.0099 0.4828 0.5
Echinococcus multilocularis farnesyl pyrophosphate synthase 0.0099 0.4828 0.4828
Echinococcus multilocularis serotonin receptor 0.0164 1 1
Onchocerca volvulus 0.0039 0 0.5
Trichomonas vaginalis geranylgeranyl pyrophosphate synthase, putative 0.0099 0.4828 0.5
Plasmodium vivax geranylgeranyl pyrophosphate synthase 0.0099 0.4828 0.5
Trypanosoma cruzi farnesyl pyrophosphate synthase, putative 0.0099 0.4828 0.5
Trichomonas vaginalis geranylgeranyl pyrophosphate synthase, putative 0.0099 0.4828 0.5
Entamoeba histolytica hypothetical protein 0.004 0.0006 0.5
Echinococcus granulosus farnesyl pyrophosphate synthase 0.0099 0.4828 0.4828
Toxoplasma gondii polyprenyl synthetase superfamily protein 0.0099 0.4828 0.5
Trypanosoma cruzi farnesyl pyrophosphate synthase 0.0099 0.4828 0.5
Onchocerca volvulus 0.0039 0 0.5
Onchocerca volvulus 0.0039 0 0.5
Schistosoma mansoni hypothetical protein 0.004 0.0006 0.0006
Mycobacterium ulcerans geranylgeranyl pyrophosphate synthase 0.0099 0.4828 0.5
Leishmania major farnesyl pyrophosphate synthase 0.0099 0.4828 0.5
Entamoeba histolytica hypothetical protein 0.004 0.0006 0.5
Onchocerca volvulus 0.0039 0 0.5
Onchocerca volvulus 0.0039 0 0.5
Onchocerca volvulus 0.0039 0 0.5
Mycobacterium tuberculosis Probable geranylgeranyl pyrophosphate synthetase IdsA2 (ggppsase) (GGPP synthetase) (geranylgeranyl diphosphate synthase) 0.0099 0.4828 0.5
Loa Loa (eye worm) hypothetical protein 0.0164 1 1
Onchocerca volvulus 0.0039 0 0.5
Trypanosoma brucei farnesyl pyrophosphate synthase 0.0099 0.4828 0.5
Brugia malayi Polyprenyl synthetase family protein 0.0099 0.4828 1
Loa Loa (eye worm) hypothetical protein 0.0164 1 1
Onchocerca volvulus 0.0039 0 0.5
Entamoeba histolytica hypothetical protein 0.004 0.0006 0.5
Onchocerca volvulus 0.0039 0 0.5
Plasmodium falciparum geranylgeranyl pyrophosphate synthase, putative 0.0099 0.4828 0.5
Loa Loa (eye worm) polyprenyl synthetase 0.0099 0.4828 0.4828
Onchocerca volvulus 0.0039 0 0.5
Onchocerca volvulus 0.0039 0 0.5
Giardia lamblia Farnesyl diphosphate synthase 0.0099 0.4828 0.5
Schistosoma mansoni biogenic amine (5HT) receptor 0.0164 1 1
Onchocerca volvulus 0.0039 0 0.5
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.004 0.0006 0.0006
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.004 0.0006 0.0006
Onchocerca volvulus 0.0039 0 0.5
Brugia malayi hypothetical protein 0.004 0.0006 0.0013
Echinococcus multilocularis serotonin receptor 0.0164 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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