Detailed information for compound 1540478

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 285.685 | Formula: C14H8ClN3O2
  • H donors: 0 H acceptors: 4 LogP: 3.12 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: N#C/C(=C/c1ccc(c(c1)[N+](=O)[O-])Cl)/c1ccccn1
  • InChi: 1S/C14H8ClN3O2/c15-12-5-4-10(8-14(12)18(19)20)7-11(9-16)13-3-1-2-6-17-13/h1-8H/b11-7-
  • InChiKey: FKPSTRSNPVWINL-XFFZJAGNSA-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) hypothetical protein 0.0041 0.0271 0.0539
Loa Loa (eye worm) transcription factor SMAD2 0.0144 0.1537 0.3051
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0045 0.5
Schistosoma mansoni hypothetical protein 0.0041 0.0271 0.0271
Schistosoma mansoni ap endonuclease 0.0023 0.0045 0.0045
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0023 0.0045 0.5
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0271 0.1767
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0706 0.0706
Brugia malayi TAR-binding protein 0.0076 0.0706 0.4591
Loa Loa (eye worm) hypothetical protein 0.0429 0.5037 1
Loa Loa (eye worm) MH2 domain-containing protein 0.0144 0.1537 0.3051
Brugia malayi RNA binding protein 0.0076 0.0706 0.4591
Giardia lamblia Endonuclease/Exonuclease/phosphatase 0.0023 0.0045 0.5
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0505 0.1003
Echinococcus multilocularis geminin 0.0205 0.2279 0.2279
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0023 0.0045 0.0045
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0706 0.0706
Loa Loa (eye worm) isocitrate dehydrogenase 0.0019 0 0.0001
Loa Loa (eye worm) TAR-binding protein 0.0076 0.0706 0.1401
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0023 0.0045 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0505 0.3289
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0023 0.0045 0.0045
Brugia malayi isocitrate dehydrogenase 0.0019 0 0.0002
Loa Loa (eye worm) hypothetical protein 0.006 0.0505 0.1003
Schistosoma mansoni microtubule-associated protein tau 0.0833 1 1
Wolbachia endosymbiont of Brugia malayi exonuclease III 0.0023 0.0045 0.5
Toxoplasma gondii hypothetical protein 0.0429 0.5037 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0023 0.0045 1
Trichomonas vaginalis ap endonuclease, putative 0.0023 0.0045 0.5
Brugia malayi RNA recognition motif domain containing protein 0.0076 0.0706 0.4591
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0023 0.0045 1
Echinococcus multilocularis tar DNA binding protein 0.0076 0.0706 0.0706
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0076 0.0706 0.1401
Loa Loa (eye worm) RNA binding protein 0.0076 0.0706 0.1401
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0045 1
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0023 0.0045 1
Toxoplasma gondii exonuclease III APE 0.0023 0.0045 0.0089
Loa Loa (eye worm) inward rectifying k channel family protein 1 0.0429 0.5037 1
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0023 0.0045 1
Echinococcus granulosus geminin 0.0205 0.2279 0.2279
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0023 0.0045 1
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0706 0.0706
Brugia malayi exodeoxyribonuclease III family protein 0.0023 0.0045 0.0293
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0023 0.0045 0.0089
Echinococcus granulosus tar DNA binding protein 0.0076 0.0706 0.0706
Brugia malayi MH2 domain containing protein 0.0144 0.1537 1
Treponema pallidum exodeoxyribonuclease (exoA) 0.0023 0.0045 0.5
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0706 0.0706
Schistosoma mansoni hypothetical protein 0.0205 0.2279 0.2279
Schistosoma mansoni tar DNA-binding protein 0.0076 0.0706 0.0706
Brugia malayi Isocitrate dehydrogenase 0.0019 0 0.0002
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0505 0.3289
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0023 0.0045 1
Schistosoma mansoni ap endonuclease 0.0023 0.0045 0.0045
Schistosoma mansoni hypothetical protein 0.0205 0.2279 0.2279
Echinococcus multilocularis microtubule associated protein 2 0.0833 1 1
Loa Loa (eye worm) hypothetical protein 0.0429 0.5037 1
Loa Loa (eye worm) hypothetical protein 0.0429 0.5037 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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