Detailed information for compound 1503407

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 239.316 | Formula: C15H17N3
  • H donors: 2 H acceptors: 1 LogP: 3.96 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(CNc1ncc2c(c1)c1ccccc1[nH]2)C
  • InChi: 1S/C15H17N3/c1-10(2)8-16-15-7-12-11-5-3-4-6-13(11)18-14(12)9-17-15/h3-7,9-10,18H,8H2,1-2H3,(H,16,17)
  • InChiKey: LSKZONQVXXSOOB-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
Onchocerca volvulus 0.0042 0.1466 0.5
Mycobacterium ulcerans putative regulatory protein 0.0042 0.1466 1
Trichomonas vaginalis DNA polymerase eta, putative 0.0019 0.0156 0.5
Echinococcus multilocularis geminin 0.0175 0.9093 1
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.0019 0.0156 0.0967
Leishmania major DNA polymerase eta, putative 0.0045 0.1616 1
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.0019 0.0156 0.0172
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0031 0.0853 1
Brugia malayi hypoxia-induced factor 1 0.0176 0.9152 0.9152
Brugia malayi TAR-binding protein 0.013 0.6524 0.6524
Schistosoma mansoni tar DNA-binding protein 0.013 0.6524 0.7175
Schistosoma mansoni aryl hydrocarbon receptor 0.0057 0.2314 0.2545
Echinococcus granulosus geminin 0.0175 0.9093 1
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Loa Loa (eye worm) transcription factor SMAD2 0.0122 0.6042 0.6042
Loa Loa (eye worm) cytochrome P450 family protein 0.0061 0.256 0.256
Schistosoma mansoni hypothetical protein 0.0035 0.1075 0.1182
Loa Loa (eye worm) MH2 domain-containing protein 0.0122 0.6042 0.6042
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 0.2012 0.2012
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Echinococcus granulosus tar DNA binding protein 0.013 0.6524 0.7175
Brugia malayi RNA binding protein 0.013 0.6524 0.6524
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0156 0.1066
Echinococcus granulosus dna polymerase kappa 0.0019 0.0156 0.0172
Mycobacterium leprae Conserved hypothetical protein 0.0017 0 0.5
Brugia malayi ImpB/MucB/SamB family protein 0.0045 0.1616 0.1616
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0051 0.2012 0.2012
Echinococcus granulosus dna polymerase eta 0.0045 0.1616 0.1777
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0156 0.0967
Trypanosoma brucei unspecified product 0.0019 0.0156 0.0967
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0156 0.0967
Echinococcus granulosus single minded 2 0.0042 0.1466 0.1612
Trypanosoma cruzi DNA polymerase eta, putative 0.0031 0.0853 0.528
Brugia malayi Cytochrome P450 family protein 0.0061 0.256 0.256
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Schistosoma mansoni single-minded 0.0057 0.2314 0.2545
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.1672 0.1838
Schistosoma mansoni tar DNA-binding protein 0.013 0.6524 0.7175
Trypanosoma cruzi DNA polymerase eta, putative 0.0045 0.1616 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.013 0.6524 0.6524
Schistosoma mansoni hypothetical protein 0.0175 0.9093 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.1672 0.1838
Loa Loa (eye worm) RNA binding protein 0.013 0.6524 0.6524
Loa Loa (eye worm) hypoxia-induced factor 1 0.0176 0.9152 0.9152
Trypanosoma brucei DNA polymerase IV, putative 0.0019 0.0156 0.0967
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Loa Loa (eye worm) hypothetical protein 0.0035 0.1075 0.1075
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Schistosoma mansoni terminal deoxycytidyl transferase 0.0019 0.0156 0.0172
Leishmania major DNA polymerase eta, putative 0.0031 0.0853 0.528
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.1672 0.1672
Echinococcus multilocularis tar DNA binding protein 0.013 0.6524 0.7175
Schistosoma mansoni tar DNA-binding protein 0.013 0.6524 0.7175
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.1672 0.1672
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Brugia malayi MH2 domain containing protein 0.0122 0.6042 0.6042
Entamoeba histolytica deoxycytidyl transferase, putative 0.0019 0.0156 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.1672 0.1838
Schistosoma mansoni hypothetical protein 0.0175 0.9093 1
Schistosoma mansoni DNA polymerase eta 0.0045 0.1616 0.1777
Brugia malayi RNA recognition motif domain containing protein 0.013 0.6524 0.6524
Brugia malayi PAS domain containing protein 0.0057 0.2314 0.2314
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.0019 0.0156 0.0172
Loa Loa (eye worm) hypothetical protein 0.0045 0.1616 0.1616
Mycobacterium tuberculosis Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed)) 0.0019 0.0156 1
Giardia lamblia DINP protein human, muc B family 0.0019 0.0156 0.5
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Echinococcus multilocularis dna polymerase eta 0.0045 0.1616 0.1777
Mycobacterium ulcerans DNA polymerase IV 0.0019 0.0156 0.1066
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Mycobacterium leprae putative cytochrome p450 0.0017 0 0.5
Leishmania major DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.0019 0.0156 0.0156
Echinococcus multilocularis dna polymerase kappa 0.0019 0.0156 0.0172
Echinococcus multilocularis transfer RNA-Lys 0.0042 0.1466 0.1612
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 0.2012 0.2012
Schistosoma mansoni tar DNA-binding protein 0.013 0.6524 0.7175
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.0019 0.0156 0.0172
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.0019 0.0156 0.5
Mycobacterium tuberculosis Conserved hypothetical protein 0.0019 0.0156 1
Schistosoma mansoni tar DNA-binding protein 0.013 0.6524 0.7175
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.1672 0.1838
Loa Loa (eye worm) hypothetical protein 0.0051 0.2012 0.2012
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.1672 0.1838
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.1075 0.1075
Loa Loa (eye worm) TAR-binding protein 0.013 0.6524 0.6524
Brugia malayi bHLH-PAS transcription factor 0.0042 0.1466 0.1466
Trypanosoma cruzi DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Loa Loa (eye worm) hypothetical protein 0.019 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.1672 0.1838
Brugia malayi ImpB/MucB/SamB family protein 0.0019 0.0156 0.0156
Trypanosoma brucei DNA polymerase kappa, putative 0.0019 0.0156 0.0967
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.1672 0.1838
Trypanosoma brucei DNA polymerase eta, putative 0.0045 0.1616 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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