Detailed information for compound 1945939

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 315.362 | Formula: C15H25NO6
  • H donors: 3 H acceptors: 4 LogP: 1.93 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCC[C@@H]1OC(=C([C@@H]([C@@]1(C)O)O)C(=O)O)/C(=N/OC)/C
  • InChi: 1S/C15H25NO6/c1-5-6-7-8-10-15(3,20)13(17)11(14(18)19)12(22-10)9(2)16-21-4/h10,13,17,20H,5-8H2,1-4H3,(H,18,19)/b16-9+/t10-,13-,15-/m0/s1
  • InChiKey: FPUJYQIUKJKYKE-CRTZVLTCSA-N  

Network

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Synonyms

No synonyms found for this compound

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 FKBP12 rapamycin complex associated protein 0.0049 0.9391 0.9334
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.0023 0.2626 0.207
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.9391 1
Brugia malayi hypothetical protein 0.004 0.7181 0.6915
Trypanosoma cruzi target of rapamycin kinase 3 0.0039 0.6775 0.6934
Trypanosoma brucei FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative 0.002 0.1887 0.1204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.6102 0.6498
Trichomonas vaginalis PIKK family atypical protein kinase 0.0042 0.7514 0.8002
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.0049 0.9391 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.3476 0.3702
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.0049 0.9391 0.9334
Trichomonas vaginalis PIKK family atypical protein kinase 0.0016 0.0861 0.0916
Trichomonas vaginalis PIKK family atypical protein kinase 0.0039 0.6765 0.7204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0016 0.0861 0.0916
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.4149 0.4418
Trichomonas vaginalis PIKK family atypical protein kinase 0.0039 0.6765 0.7204
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.0049 0.9391 1
Leishmania major target of rapamycin kinase (TOR) kinase 3 0.0039 0.6775 0.6934
Loa Loa (eye worm) phosphatidylinositol 3 0.0049 0.9391 0.9334
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.4225 0.4499
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.3487 0.3713
Toxoplasma gondii target of rapamycin (TOR), putative 0.0036 0.6102 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.6102 0.6498
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.0049 0.9391 0.9334
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.004 0.7181 0.6915
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.0049 0.9391 1
Echinococcus granulosus FKBP12 rapamycin complex associated protein 0.0049 0.9391 0.9334
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.0049 0.9391 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.004 0.7181 0.6915
Trypanosoma brucei target of rapamycin kinase 3, putative 0.0039 0.6775 0.6934
Trichomonas vaginalis PIKK family atypical protein kinase 0.0039 0.6765 0.7204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.6102 0.6498
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.3476 0.3702
Giardia lamblia GTOR 0.0049 0.9391 0.5
Trichomonas vaginalis PIKK family atypical protein kinase 0.0016 0.0861 0.0916
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.6102 0.6498
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.3487 0.3713
Trichomonas vaginalis PIKK family atypical protein kinase 0.0032 0.4888 0.5205
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.9391 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.3487 0.3713
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.0049 0.9391 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.4149 0.4418
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.6102 0.6498
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.4225 0.4499
Schistosoma mansoni hypothetical protein 0.004 0.7181 0.6915
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.0049 0.9391 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0039 0.6765 0.7204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0029 0.4225 0.4499
Trichomonas vaginalis PIKK family atypical protein kinase 0.0016 0.0861 0.0916
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.6102 0.6498
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.3476 0.3702
Trichomonas vaginalis PIKK family atypical protein kinase 0.0026 0.3487 0.3713
Schistosoma mansoni transcription factor LCR-F1 0.004 0.7181 0.6915
Trichomonas vaginalis PIKK family atypical protein kinase 0.0049 0.9391 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0033 0.5166 0.5501
Trichomonas vaginalis PIKK family atypical protein kinase 0.0039 0.6765 0.7204
Trichomonas vaginalis PIKK family atypical protein kinase 0.0036 0.6102 0.6498
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.0049 0.9391 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.0016 0.0861 0.0916
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.0049 0.9391 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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