Detailed information for compound 1586165

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 319.438 | Formula: C19H29NO3
  • H donors: 0 H acceptors: 1 LogP: 4.46 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCOc1ccc(cc1)C(=O)O[C@@H]1C[C@@H](C)N(C[C@H]1C)C
  • InChi: 1S/C19H29NO3/c1-5-6-11-22-17-9-7-16(8-10-17)19(21)23-18-12-15(3)20(4)13-14(18)2/h7-10,14-15,18H,5-6,11-13H2,1-4H3/t14-,15-,18-/m1/s1
  • InChiKey: RIKXLROQYQSOHV-IIDMSEBBSA-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
Schistosoma mansoni egf-like domain protein 0.0117 0.4505 0.4505
Toxoplasma gondii calcium binding egf domain-containing protein 0.0117 0.4505 1
Brugia malayi Calcium binding EGF domain containing protein 0.0117 0.4505 1
Loa Loa (eye worm) hypothetical protein 0.006 0.098 0.2177
Giardia lamblia High cysteine protein 0.0044 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0117 0.4505 1
Echinococcus multilocularis Tolloid protein 1 0.0117 0.4505 0.4505
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0045 0.0006 0.5
Echinococcus multilocularis laminin 0.0117 0.4505 0.4505
Trichomonas vaginalis inositol monophosphatase, putative 0.0045 0.0006 0.5
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0045 0.0006 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.098 0.2177
Echinococcus granulosus Tolloid protein 1 0.0117 0.4505 0.4505
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0006 0.5
Loa Loa (eye worm) multiple epidermal growth factor-like domains 6 0.0117 0.4505 1
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0006 0.5
Brugia malayi Inositol-1 0.0045 0.0006 0.0014
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0045 0.0006 0.5
Echinococcus multilocularis inositol monophosphatase 1 0.0045 0.0006 0.0006
Loa Loa (eye worm) hypothetical protein 0.0117 0.4505 1
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0045 0.0006 0.5
Loa Loa (eye worm) low-density lipoprotein receptor repeat class B containing protein 0.0117 0.4505 1
Schistosoma mansoni hypothetical protein 0.0205 1 1
Schistosoma mansoni inositol monophosphatase 0.0045 0.0006 0.0006
Echinococcus multilocularis geminin 0.0205 1 1
Echinococcus multilocularis fibrillin 1 0.0117 0.4505 0.4505
Loa Loa (eye worm) hypothetical protein 0.0117 0.4505 1
Toxoplasma gondii calcium binding egf domain-containing protein 0.0117 0.4505 1
Loa Loa (eye worm) inositol-1 0.0045 0.0006 0.0014
Schistosoma mansoni subfamily M12A unassigned peptidase (M12 family) 0.0117 0.4505 0.4505
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0006 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.098 0.2177
Loa Loa (eye worm) hypothetical protein 0.0117 0.4505 1
Schistosoma mansoni inositol monophosphatase 0.0045 0.0006 0.0006
Loa Loa (eye worm) bone morphogenetic protein 1b 0.0117 0.4505 1
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0045 0.0006 0.0014
Echinococcus granulosus inositol monophosphatase 1 0.0045 0.0006 0.0006
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.098 0.2177
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0045 0.0006 0.5
Onchocerca volvulus Arrow homolog 0.0117 0.4505 1
Brugia malayi Low-density lipoprotein receptor repeat class B containing protein 0.0117 0.4505 1
Echinococcus granulosus laminin 0.0117 0.4505 0.4505
Schistosoma mansoni hypothetical protein 0.0205 1 1
Brugia malayi Fibulin-1 precursor 0.0117 0.4505 1
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0045 0.0006 0.5
Loa Loa (eye worm) hypothetical protein 0.0117 0.4505 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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