Detailed information for compound 1811634

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 244.289 | Formula: C14H16N2O2
  • H donors: 0 H acceptors: 2 LogP: 2.4 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCC(=O)n1c(=O)n(c2c1cccc2)C(=C)C
  • InChi: 1S/C14H16N2O2/c1-4-7-13(17)16-12-9-6-5-8-11(12)15(10(2)3)14(16)18/h5-6,8-9H,2,4,7H2,1,3H3
  • InChiKey: GVTLUNFCVWZJDG-UHFFFAOYSA-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 epidermal growth factor receptor 0.0255 0.2256 0.2256
Brugia malayi Furin-like cysteine rich region family protein 0.0474 0.684 1
Echinococcus multilocularis insulin receptor 0.0151 0.0099 0.0099
Echinococcus multilocularis high affinity choline transporter 1 0.0159 0.0268 0.0268
Schistosoma mansoni inositol transporter 0.0625 1 1
Loa Loa (eye worm) hypothetical protein 0.0159 0.0268 0.025
Schistosoma mansoni high-affinity choline transporter 0.0159 0.0268 0.017
Schistosoma mansoni tyrosine kinase 0.0474 0.684 0.6808
Schistosoma mansoni tyrosine kinase 0.0252 0.22 0.2122
Schistosoma mansoni inositol transporter 0.0625 1 1
Loa Loa (eye worm) TK/EGFR protein kinase 0.0474 0.684 1
Echinococcus multilocularis solute carrier family 5 0.0625 1 1
Echinococcus granulosus high affinity choline transporter 1 0.0159 0.0268 0.017
Echinococcus multilocularis sodium:myo inositol cotransporter 0.0625 1 1
Brugia malayi Sodium:solute symporter family protein 0.0159 0.0268 0.025
Echinococcus multilocularis sodium:glucose cotransporter 2 0.0625 1 1
Echinococcus granulosus melanoma receptor tyrosine protein kinase 0.0255 0.2256 0.2179
Loa Loa (eye worm) hypothetical protein 0.0159 0.0268 0.025
Schistosoma mansoni tyrosine kinase 0.0255 0.2256 0.2179
Schistosoma mansoni tyrosine kinase 0.0252 0.22 0.2122
Schistosoma mansoni tyrosine kinase 0.0252 0.22 0.2122
Onchocerca volvulus 0.0159 0.0268 0.5
Schistosoma mansoni tyrosine kinase 0.0255 0.2256 0.2179
Echinococcus granulosus epidermal growth factor receptor 0.0255 0.2256 0.2179
Brugia malayi GH02984p 0.0159 0.0268 0.025
Echinococcus multilocularis epidermal growth factor receptor 0.0474 0.684 0.684
Echinococcus granulosus sodium:glucose cotransporter 2 0.0625 1 1
Echinococcus granulosus solute carrier family 5 0.0625 1 1
Echinococcus granulosus sodium coupled monocarboxylate transporter 1 0.0159 0.0268 0.017
Echinococcus multilocularis sodium coupled monocarboxylate transporter 1 0.0159 0.0268 0.0268
Echinococcus multilocularis insulin growth factor 1 receptor beta 0.0151 0.0099 0.0099
Schistosoma mansoni sodium/solute symporter 0.0159 0.0268 0.017
Echinococcus granulosus epidermal growth factor receptor 0.0474 0.684 0.6808
Echinococcus granulosus sodium:myo inositol cotransporter 0.0625 1 1
Toxoplasma gondii transporter, solute:sodium symporter (SSS) family protein 0.0159 0.0268 0.5

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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