Detailed information for compound 235277

Basic information

Technical information
  • TDR Targets ID: 235277
  • Name: 3-phenyl-3-piperidin-1-ylcyclohexan-1-ol
  • MW: 259.386 | Formula: C17H25NO
  • H donors: 1 H acceptors: 1 LogP: 3.04 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: OC1CCCC(C1)(N1CCCCC1)c1ccccc1
  • InChi: 1S/C17H25NO/c19-16-10-7-11-17(14-16,15-8-3-1-4-9-15)18-12-5-2-6-13-18/h1,3-4,8-9,16,19H,2,5-7,10-14H2
  • InChiKey: NHEKQIGDKRYTQF-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-phenyl-3-(1-piperidyl)cyclohexanol
  • 3-phenyl-3-piperidin-1-yl-cyclohexan-1-ol
  • 3-phenyl-3-piperidino-cyclohexanol
  • 3-phenyl-3-(1-piperidyl)cyclohexan-1-ol
  • 3-phenyl-3-(1-piperidyl)-1-cyclohexanol
  • 3-phenyl-3-piperidino-cyclohexan-1-ol
  • 3-phenyl-3-piperidinocyclohexanol (TMS)

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
Leishmania major gamma-tubulin 0.013 0.421 0.4188
Echinococcus granulosus Tubulin beta 2C chain 0.0233 1 1
Echinococcus granulosus Tubulin alpha 1 chain 0.0186 0.7373 0.7363
Loa Loa (eye worm) BEN-1 protein 0.0233 1 1
Brugia malayi tubulin alpha chain - mouse 0.0186 0.7373 0.7363
Loa Loa (eye worm) alpha-tubulin 0.0186 0.7373 0.7373
Plasmodium vivax tubulin alpha chain, putative 0.0186 0.7373 0.7363
Trichomonas vaginalis tubulin alpha chain, putative 0.013 0.421 0.4188
Plasmodium vivax tubulin beta chain, putative 0.0233 1 1
Treponema pallidum cell division protein FtsZ 0.0057 0.0038 0.5
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Plasmodium vivax tubulin alpha chain, putative 0.0186 0.7373 0.7363
Trypanosoma cruzi epsilon tubulin, putative 0.013 0.421 0.4188
Leishmania major beta tubulin 0.0233 1 1
Echinococcus multilocularis tubulin alpha 1C chain 0.0186 0.7373 0.7363
Echinococcus multilocularis peroxisome assembly protein 26 0.0186 0.7373 0.7363
Echinococcus granulosus alpha tubulin 0.0186 0.7373 0.7363
Brugia malayi Tubulin alpha-2 chain 0.0186 0.7373 0.7363
Toxoplasma gondii alpha tubulin TUBA1 0.0186 0.7373 0.7363
Trypanosoma cruzi beta tubulin, putative 0.0233 1 1
Loa Loa (eye worm) hypothetical protein 0.0113 0.3201 0.3201
Echinococcus granulosus Tubulin beta 2C chain 0.0233 1 1
Toxoplasma gondii beta-tubulin, putative 0.0233 1 1
Giardia lamblia Alpha-tubulin 0.0186 0.7373 0.7363
Leishmania major beta tubulin 0.0233 1 1
Loa Loa (eye worm) tubulin beta-4 chain 0.0233 1 1
Trypanosoma cruzi tubulin gamma chain 0.013 0.421 0.4188
Trypanosoma brucei tubulin gamma chain 0.013 0.421 0.4188
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0186 0.7373 0.7363
Toxoplasma gondii alpha-tubulin I, putative 0.0186 0.7373 0.7363
Plasmodium falciparum tubulin epsilon chain, putative 0.013 0.421 0.4188
Loa Loa (eye worm) tubulin beta-1 chain 0.0233 1 1
Loa Loa (eye worm) hypothetical protein 0.0186 0.7373 0.7373
Echinococcus granulosus tubulin subunit TubB 0.0186 0.7373 0.7363
Echinococcus granulosus tubulin alpha 0.013 0.421 0.4188
Echinococcus multilocularis tubulin alpha 3 chain 0.0186 0.7373 0.7363
Trypanosoma brucei beta tubulin 0.013 0.421 0.4188
Brugia malayi Tubulin alpha-2 chain 0.0186 0.7373 0.7363
Brugia malayi alpha-tubulin 0.0186 0.7373 0.7363
Schistosoma mansoni alpha tubulin 0.0186 0.7373 0.7363
Leishmania major beta tubulin 0.0233 1 1
Trypanosoma brucei beta tubulin 0.0233 1 1
Leishmania major beta tubulin 0.0233 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0074 0.1009 0.0974
Trypanosoma brucei alpha tubulin, putative 0.0074 0.1009 0.0974
Trichomonas vaginalis tubulin beta chain, putative 0.0186 0.7373 0.7363
Schistosoma mansoni tubulin subunit beta 0.0233 1 1
Loa Loa (eye worm) tubulin beta-2A chain 0.0233 1 1
Schistosoma mansoni hypothetical protein 0.0164 0.6129 0.6115
Entamoeba histolytica tubulin family protein 0.0233 1 1
Plasmodium vivax tubulin epsilon chain, putative 0.013 0.421 0.4188
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Giardia lamblia Beta tubulin 0.0233 1 1
Echinococcus multilocularis Tubulin beta 2C chain 0.0233 1 1
Toxoplasma gondii beta tubulin 0.0233 1 1
Mycobacterium ulcerans cell division protein FtsZ 0.0057 0.0038 0.5
Echinococcus multilocularis Tubulin alpha 1 chain 0.0186 0.7373 0.7363
Echinococcus granulosus peroxisome assembly protein 26 0.0186 0.7373 0.7363
Echinococcus granulosus tubulin alpha chain 0.0186 0.7373 0.7363
Trypanosoma brucei beta tubulin 0.0233 1 1
Echinococcus multilocularis tubulin alpha chain 0.0186 0.7373 0.7363
Echinococcus multilocularis tubulin, beta 4A class IVa 0.0233 1 1
Echinococcus multilocularis tubulin alpha chain 0.0186 0.7373 0.7363
Echinococcus multilocularis tubulin subunit TubB 0.0186 0.7373 0.7363
Trypanosoma cruzi alpha tubulin, putative 0.0186 0.7373 0.7363
Echinococcus multilocularis tubulin alpha chain 0.0186 0.7373 0.7363
Trichomonas vaginalis tubulin epsilon chain, putative 0.0233 1 1
Entamoeba histolytica tubulin family protein 0.0233 1 1
Loa Loa (eye worm) tubulin alpha 2 0.013 0.4172 0.4172
Schistosoma mansoni tubulin subunit gamma 0.013 0.421 0.4188
Trypanosoma brucei epsilon tubulin 0.013 0.421 0.4188
Echinococcus multilocularis Tubulin beta 2C chain 0.0233 1 1
Trypanosoma brucei epsilon tubulin 0.013 0.421 0.4188
Onchocerca volvulus 0.0146 0.5124 1
Leishmania major beta tubulin 0.0233 1 1
Loa Loa (eye worm) alpha-tubulin 0.0186 0.7373 0.7373
Loa Loa (eye worm) tubulin alpha chain 0.0186 0.7373 0.7373
Brugia malayi tubulin alpha-2 chain 0.0186 0.7373 0.7363
Echinococcus multilocularis Tubulin beta 2C chain 0.0233 1 1
Plasmodium falciparum tubulin gamma chain 0.013 0.421 0.4188
Plasmodium falciparum tubulin beta chain 0.0233 1 1
Trypanosoma brucei epsilon tubulin 0.013 0.421 0.4188
Schistosoma mansoni tubulin subunit alpha 0.0186 0.7373 0.7363
Echinococcus multilocularis tubulin alpha 0.013 0.421 0.4188
Leishmania major beta tubulin 0.0233 1 1
Trichomonas vaginalis tubulin gamma chain, putative 0.0233 1 1
Giardia lamblia Gamma tubulin 0.013 0.421 0.4188
Echinococcus granulosus Tubulin beta 2C chain 0.0233 1 1
Schistosoma mansoni hypothetical protein 0.0164 0.6129 0.6115
Schistosoma mansoni tubulin subunit beta 0.0233 1 1
Trichomonas vaginalis tubulin, putative 0.0233 1 1
Trichomonas vaginalis tubulin gamma chain, putative 0.013 0.421 0.4188
Echinococcus granulosus tubulin alpha 1C chain 0.0186 0.7373 0.7363
Trichomonas vaginalis tubulin epsilon chain, putative 0.0186 0.7373 0.7363
Echinococcus granulosus geminin 0.0164 0.6129 0.6115
Loa Loa (eye worm) alpha-tubulin isotype 2 0.013 0.4172 0.4172
Echinococcus multilocularis beta tubulin 0.0233 1 1
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Leishmania major beta tubulin 0.0233 1 1
Loa Loa (eye worm) tubulin alpha-3 chain 0.0113 0.3201 0.3201
Leishmania major beta tubulin 0.0233 1 1
Wolbachia endosymbiont of Brugia malayi cell division protein FtsZ 0.0057 0.0038 0.5
Echinococcus granulosus Tubulin alpha 1 chain 0.0186 0.7373 0.7363
Trichomonas vaginalis tubulin gamma chain, putative 0.013 0.421 0.4188
Echinococcus granulosus beta tubulin 0.0233 1 1
Echinococcus multilocularis Tubulin beta 2C chain 0.0233 1 1
Giardia lamblia Alpha-tubulin 0.0186 0.7373 0.7363
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Loa Loa (eye worm) tubulin alpha-2 chain 0.0186 0.7373 0.7373
Trichomonas vaginalis tubulin beta chain, putative 0.0186 0.7373 0.7363
Schistosoma mansoni tubulin subunit epsilon 0.013 0.421 0.4188
Loa Loa (eye worm) hypothetical protein 0.013 0.4172 0.4172
Loa Loa (eye worm) tubulin gamma chain 0.013 0.421 0.421
Echinococcus multilocularis geminin 0.0164 0.6129 0.6115
Echinococcus multilocularis tubulin alpha 3 chain 0.0186 0.7373 0.7363
Loa Loa (eye worm) tubulin beta chain 0.0233 1 1
Echinococcus multilocularis tubulin alpha chain 0.0186 0.7373 0.7363
Loa Loa (eye worm) tubulin beta chain 0.0057 0.0038 0.0038
Brugia malayi Tubulin gamma chain 0.013 0.421 0.4188
Brugia malayi Tubulin alpha chain 0.0186 0.7373 0.7363
Trypanosoma brucei alpha tubulin 0.0186 0.7373 0.7363
Echinococcus multilocularis tubulin alpha 1C chain 0.0186 0.7373 0.7363
Echinococcus granulosus tubulin alpha chain 0.0186 0.7373 0.7363
Echinococcus granulosus tubulin alpha 1C chain 0.0186 0.7373 0.7363
Echinococcus multilocularis tubulin alpha chain 0.0186 0.7373 0.7363
Brugia malayi hypothetical protein 0.0146 0.5124 0.5105
Echinococcus granulosus tubulin epsilon chain 0.013 0.421 0.4188
Trichomonas vaginalis tubulin beta chain, putative 0.0186 0.7373 0.7363
Leishmania major beta tubulin 0.0233 1 1
Entamoeba histolytica tubulin alpha chain, putative 0.0186 0.7373 0.5463
Loa Loa (eye worm) BEN-1 protein 0.0233 1 1
Echinococcus granulosus tubulin alpha 3 chain 0.0186 0.7373 0.7363
Echinococcus multilocularis Tubulin alpha 1 chain 0.0186 0.7373 0.7363
Trichomonas vaginalis tubulin alpha chain, putative 0.0233 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.0186 0.7373 0.7363
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Trypanosoma brucei alpha tubulin 0.0186 0.7373 0.7363
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Echinococcus multilocularis tubulin epsilon chain 0.013 0.421 0.4188
Leishmania major beta tubulin 0.0233 1 1
Leishmania major beta tubulin 0.0233 1 1
Loa Loa (eye worm) tubulin alpha 2 0.013 0.4172 0.4172
Giardia lamblia Beta tubulin 0.0233 1 1
Leishmania major beta tubulin 0.0233 1 1
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Echinococcus multilocularis Tubulin alpha 1 chain 0.0186 0.7373 0.7363
Trichomonas vaginalis tubulin beta chain, putative 0.0186 0.7373 0.7363
Trypanosoma brucei beta tubulin 0.0233 1 1
Giardia lamblia Beta tubulin 0.0233 1 1
Loa Loa (eye worm) tubulin alpha chain 0.0186 0.7373 0.7373
Plasmodium falciparum alpha tubulin 1 0.0186 0.7373 0.7363
Schistosoma mansoni tubulin subunit beta 0.0233 1 1
Loa Loa (eye worm) beta-tubulin 0.0233 1 1
Mycobacterium leprae cell division protein FtsZ 0.0057 0.0038 0.5
Echinococcus granulosus Tubulin beta 2C chain 0.0233 1 1
Trichomonas vaginalis tubulin beta chain, putative 0.0233 1 1
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Schistosoma mansoni alpha tubulin 0.0186 0.7373 0.7363
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Echinococcus granulosus tubulin subunit beta 0.0233 1 1
Trichomonas vaginalis tubulin epsilon chain, putative 0.0186 0.7373 0.7363
Leishmania major beta tubulin 0.0233 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0074 0.1009 0.0974
Trypanosoma cruzi epsilon tubulin, putative 0.013 0.421 0.4188
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.013 0.4172 0.4149
Echinococcus granulosus tubulin alpha 3 chain 0.0186 0.7373 0.7363
Toxoplasma gondii tubulin/FtsZ family, GTPase domain-containing protein 0.013 0.421 0.4188
Echinococcus granulosus beta tubulin 0.0233 1 1
Echinococcus multilocularis beta tubulin 0.0233 1 1
Leishmania major beta tubulin 0.0233 1 1
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Brugia malayi Tubulin beta chain 0.0074 0.1009 0.0974
Echinococcus multilocularis hypothetical protein 0.0186 0.7373 0.7363
Trichomonas vaginalis tubulin epsilon chain, putative 0.0233 1 1
Mycobacterium tuberculosis Cell division protein FtsZ 0.0057 0.0038 0.5
Trypanosoma brucei alpha tubulin 0.0186 0.7373 0.7363
Entamoeba histolytica tubulin alpha-1 chain 0.0186 0.7373 0.5463
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Echinococcus granulosus tubulin beta 1 chain 0.0233 1 1
Leishmania major alpha tubulin 0.0186 0.7373 0.7363
Schistosoma mansoni tubulin subunit alpha 0.0186 0.7373 0.7363
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0113 0.3201 0.3175
Schistosoma mansoni tubulin subunit beta 0.0233 1 1
Trichomonas vaginalis tubulin, putative 0.0074 0.1009 0.0974
Echinococcus multilocularis tubulin beta 1 chain 0.0233 1 1
Trypanosoma brucei beta tubulin 0.0233 1 1
Echinococcus multilocularis tubulin subunit beta 0.0233 1 1
Echinococcus granulosus Tubulin beta 2C chain 0.0233 1 1
Echinococcus granulosus tubulin alpha chain 0.0186 0.7373 0.7363
Echinococcus multilocularis tubulin gamma 1 chain 0.013 0.421 0.4188
Leishmania major beta tubulin 0.0233 1 1
Echinococcus granulosus tubulin beta 4A class IVa 0.0233 1 1
Schistosoma mansoni tubulin subunit beta 0.0233 1 1
Trichomonas vaginalis tubulin, putative 0.0074 0.1009 0.0974
Schistosoma mansoni tubulin subunit beta 0.0233 1 1
Leishmania major beta tubulin 0.0233 1 1
Loa Loa (eye worm) hypothetical protein 0.0146 0.5124 0.5124
Schistosoma mansoni alpha tubulin 0.0186 0.7373 0.7363
Plasmodium falciparum alpha tubulin 2 0.0186 0.7373 0.7363
Trichomonas vaginalis tubulin beta chain, putative 0.0074 0.1009 0.0974
Echinococcus multilocularis Tubulin beta 2C chain 0.0233 1 1
Echinococcus granulosus tubulin alpha chain 0.0186 0.7373 0.7363
Trichomonas vaginalis tubulin alpha-1 chain, putative 0.0074 0.1009 0.0974
Echinococcus granulosus tubulin gamma 1 chain 0.013 0.421 0.4188
Leishmania major beta tubulin 0.0233 1 1
Echinococcus granulosus tubulin alpha chain 0.0186 0.7373 0.7363
Leishmania major beta tubulin 0.0233 1 1
Schistosoma mansoni tubulin subunit alpha 0.0186 0.7373 0.7363
Leishmania major epsilon tubulin, putative 0.013 0.421 0.4188
Brugia malayi beta-tubulin, identical 0.0233 1 1
Trypanosoma brucei alpha tubulin 0.0186 0.7373 0.7363
Plasmodium vivax tubulin gamma chain, putative 0.013 0.421 0.4188
Toxoplasma gondii beta-1 tubulin, putative 0.0233 1 1
Trichomonas vaginalis tubulin alpha chain, putative 0.0074 0.1009 0.0974
Echinococcus granulosus Tubulin alpha 1 chain 0.0186 0.7373 0.7363
Trichomonas vaginalis tubulin beta chain, putative 0.0186 0.7373 0.7363

Activities

Activity type Activity value Assay description Source Reference
ED50 (functional) = 49.9 mg kg-1 Effective dose for inhibition of phencyclidine binding measured in mouse rotarod assay ChEMBL. 6279847
ED50 (functional) = 49.9 mg kg-1 Effective dose for inhibition of phencyclidine binding measured in mouse rotarod assay ChEMBL. 6279847
K0.5 (binding) = 0.9 uM Inhibition of the specific binding of [3H]-phencyclidine to phencyclidine receptor ChEMBL. 6279847
K0.5 (binding) = 0.9 uM Inhibition of the specific binding of [3H]-phencyclidine to phencyclidine receptor ChEMBL. 6279847
K0.5 (binding) = 2.2 uM Inhibition of the specific binding of [3H]-phencyclidine to phencyclidine receptor ChEMBL. 6279847
K0.5 (binding) = 2.2 uM Inhibition of the specific binding of [3H]-phencyclidine to phencyclidine receptor ChEMBL. 6279847
K0.5 (binding) = 11.5 uM Inhibition of the specific binding of [3H]-Morphine to Opioid receptors ChEMBL. 6279847
K0.5 (binding) = 11.5 uM Inhibition of the specific binding of [3H]-Morphine to Opioid receptors ChEMBL. 6279847
K0.5 (binding) = 27.7 uM Inhibition of the specific binding of [3H]-Morphine to Opioid receptors ChEMBL. 6279847
K0.5 (binding) = 27.7 uM Inhibition of the specific binding of [3H]-Morphine to Opioid receptors ChEMBL. 6279847
K0.5 (binding) > 100 uM Inhibition of the specific binding of [3H]-QNB to Muscarinic acetylcholine receptor ChEMBL. 6279847
K0.5 (binding) > 100 uM Inhibition of the specific binding of [3H]-QNB to Muscarinic acetylcholine receptor ChEMBL. 6279847
nH (binding) = 0.8 Hill coefficient of the compound for binding of [3H]-Morphine to Opioid receptors ChEMBL. 6279847
nH (binding) = 1 Hill coefficient of the compound for binding of [3H]-Morphine to Opioid receptors ChEMBL. 6279847
nH (binding) = 0.8 Hill coefficient of the compound for binding of [3H]-Morphine to Opioid receptors ChEMBL. 6279847
nH (binding) = 0.9 Hill coefficient of the compound for binding of [3H]-phencyclidine to phencyclidine receptor ChEMBL. 6279847
nH (binding) = 1 Hill coefficient of the compound for binding of [3H]-Morphine to Opioid receptors ChEMBL. 6279847
nH (binding) = 1 Hill coefficient of the compound for binding of [3H]-phencyclidine to phencyclidine receptor ChEMBL. 6279847

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

1 literature reference was collected for this gene.

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