Detailed information for compound 895684

Basic information

Technical information
  • TDR Targets ID: 895684
  • Name: ChemDiv3_011799
  • MW: 294.308 | Formula: C16H14N4O2
  • H donors: 0 H acceptors: 3 LogP: 1.12 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCn1c(=O)c(C#N)cc2c1nc1ccccn1c2=O
  • InChi: 1S/C16H14N4O2/c1-2-3-7-20-14-12(9-11(10-17)15(20)21)16(22)19-8-5-4-6-13(19)18-14/h4-6,8-9H,2-3,7H2,1H3
  • InChiKey: CLXLNKCGGJRLOC-UHFFFAOYSA-N  

Network

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Synonyms

  • IDI1_029357

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 Receptor type tyrosine protein phosphatase O 0.0163 0.0475 0.0077
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0166 0.0485 0.0088
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Echinococcus multilocularis receptor type tyrosine protein phosphatase zeta 0.0144 0.0414 0.0013
Loa Loa (eye worm) fibronectin type III domain-containing protein 0.0163 0.0475 0.0475
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.2983 1 1
Trichomonas vaginalis pten, drome, putative 0.0141 0.0401 0.5
Loa Loa (eye worm) protein-tyrosine phosphatase 0.2983 1 1
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0166 0.0485 0.0088
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Schistosoma mansoni protein tyrosine phosphatase 0.0144 0.0414 0.0013
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Trypanosoma cruzi tyrosine specific protein phosphatase, putative 0.0159 0.0463 1
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Schistosoma mansoni protein tyrosine phosphatase non-receptor type nt1 0.2983 1 1
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.2089 0.6981 0.6854
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Giardia lamblia Protein tyrosine phosphatase 0.0141 0.0401 0.5
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Echinococcus granulosus receptor type tyrosine protein phosphatase zeta 0.0144 0.0414 0.0013
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0166 0.0485 0.0088
Loa Loa (eye worm) protein-tyrosine phosphatase 1 0.0141 0.0401 0.0401
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0163 0.0475 0.0077
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0159 0.0463 0.0064
Loa Loa (eye worm) dual specificity protein phosphatase CDC14B 0.0141 0.0401 0.0401
Trypanosoma brucei protein tyrosine phosphatase 1 0.0141 0.0401 0.5
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0141 0.0401 0.5
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) protein-tyrosine-phosphatase 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.2085 0.6968 0.6842
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0159 0.0463 0.0064
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0163 0.0475 0.0077
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0166 0.0485 0.0088
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0141 0.0401 0.5
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Echinococcus multilocularis receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type 0.2085 0.6968 0.6842
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.2983 1 1
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) protein tyrosine phosphatase 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Schistosoma mansoni receptor protein tyrosine phosphatase 0.0144 0.0414 0.0013
Leishmania major tyrosine specific protein phosphatase, putative 0.0159 0.0463 1
Onchocerca volvulus 0.0159 0.0463 1
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Entamoeba histolytica Pten 3-phosphoinositide phosphatase, putative 0.0141 0.0401 0.5
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0159 0.0463 0.0064
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0166 0.0485 0.0088
Trypanosoma cruzi tyrosine specific protein phosphatase, putative 0.0159 0.0463 1
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0144 0.0414 0.0013
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0166 0.0485 0.0088
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) hypothetical protein 0.0141 0.0401 0.0401
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0141 0.0401 0.0401
Brugia malayi Protein-tyrosine phosphatase 0.0144 0.0414 0.0013
Brugia malayi protein-tyrosine phosphatase Lar-like precursor, putative 0.0159 0.0463 0.0064
Echinococcus multilocularis receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type 0.0163 0.0475 0.0077

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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