Detailed information for compound 1156574

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 206.304 | Formula: C13H20NO+
  • H donors: 0 H acceptors: 0 LogP: 3.08 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccccc1[N+](CC(=C)C)(C)C
  • InChi: 1S/C13H20NO/c1-11(2)10-14(3,4)12-8-6-7-9-13(12)15-5/h6-9H,1,10H2,2-5H3/q+1
  • InChiKey: JKLVNYTUYUZKBJ-UHFFFAOYSA-N  


Substructure search Similarity search

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
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0052 1 1
Echinococcus granulosus FAD linked sulfhydryl oxidase ALR 0.0039 0.7161 0.7161
Brugia malayi Augmenter of liver regeneration 0.0039 0.7161 0.7161
Toxoplasma gondii Erv1 / Alr family protein 0.0039 0.7161 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 1 1
Loa Loa (eye worm) hepatopoietin HPO2 0.0039 0.7161 0.7161
Plasmodium vivax FAD-linked sulfhydryl oxidase ERV1, putative 0.0039 0.7161 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 1 1
Toxoplasma gondii Erv1 / Alr family protein 0.0039 0.7161 1
Trypanosoma cruzi Present in the outer mitochondrial membrane proteome 4 0.0039 0.7161 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 1 1
Onchocerca volvulus Sulfhydryl oxidase homolog 0.0006 0 0.5
Plasmodium falciparum FAD-linked sulfhydryl oxidase ERV1, putative 0.0039 0.7161 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 1 1
Leishmania major hypothetical protein, conserved 0.0039 0.7161 0.5
Onchocerca volvulus Sulfhydryl oxidase homolog 0.0006 0 0.5
Trypanosoma cruzi ERV/ALR sulfhydryl oxidase domain-containing protein 0.0039 0.7161 1
Onchocerca volvulus Sulfhydryl oxidase homolog 0.0006 0 0.5
Trypanosoma cruzi Present in the outer mitochondrial membrane proteome 4 0.0039 0.7161 1
Trypanosoma brucei ERV/ALR sulfhydryl oxidase domain-containing protein 0.0039 0.7161 1
Echinococcus multilocularis FAD linked sulfhydryl oxidase ALR 0.0039 0.7161 0.7161

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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