Detailed information for compound 1107752

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 280.364 | Formula: C18H20N2O
  • H donors: 0 H acceptors: 2 LogP: 3.23 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CN(C(=O)C1(CCCC1)c1ccccc1)c1cccnc1
  • InChi: 1S/C18H20N2O/c1-20(16-10-7-13-19-14-16)17(21)18(11-5-6-12-18)15-8-3-2-4-9-15/h2-4,7-10,13-14H,5-6,11-12H2,1H3
  • InChiKey: GBKKWXVCHQTSFI-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
Entamoeba histolytica hypothetical protein 0.007 0.119 0.5
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0265 0.5
Echinococcus multilocularis muscleblind protein 0.0449 1 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0349 0.0439
Entamoeba histolytica hypothetical protein 0.007 0.119 0.5
Schistosoma mansoni hypothetical protein 0.0041 0.0514 0.0646
Echinococcus multilocularis geminin 0.0361 0.7956 0.7956
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0265 0.5
Schistosoma mansoni tar DNA-binding protein 0.0134 0.2682 0.3371
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0034 0.0349 1
Schistosoma mansoni hypothetical protein 0.007 0.119 0.1496
Schistosoma mansoni tar DNA-binding protein 0.0134 0.2682 0.3371
Brugia malayi TAR-binding protein 0.0134 0.2682 0.2682
Schistosoma mansoni tar DNA-binding protein 0.0134 0.2682 0.3371
Brugia malayi hypothetical protein 0.007 0.119 0.119
Echinococcus multilocularis muscleblind protein 1 0.0449 1 1
Loa Loa (eye worm) RNA binding protein 0.0134 0.2682 0.2682
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0349 0.0439
Loa Loa (eye worm) hypothetical protein 0.0041 0.0514 0.0514
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0265 0.5
Entamoeba histolytica hypothetical protein 0.007 0.119 0.5
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0033 0.032 0.032
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0034 0.0349 0.0439
Brugia malayi Pre-SET motif family protein 0.0238 0.5082 0.5082
Schistosoma mansoni tar DNA-binding protein 0.0134 0.2682 0.3371
Brugia malayi latrophilin 2 splice variant baaae 0.0041 0.0514 0.0514
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0238 0.5082 0.5082
Brugia malayi RNA binding protein 0.0134 0.2682 0.2682
Entamoeba histolytica hypothetical protein 0.007 0.119 0.5
Brugia malayi hypothetical protein 0.002 0.0014 0.0014
Schistosoma mansoni transcription factor LCR-F1 0.007 0.119 0.1496
Brugia malayi Pre-SET motif family protein 0.0034 0.0349 0.0349
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0034 0.0349 0.0439
Echinococcus granulosus tar DNA binding protein 0.0134 0.2682 0.2682
Onchocerca volvulus 0.027 0.5845 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0034 0.0349 0.0349
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.006 0.0957 0.0957
Brugia malayi Calcitonin receptor-like protein seb-1 0.006 0.0957 0.0957
Schistosoma mansoni tar DNA-binding protein 0.0134 0.2682 0.3371
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.007 0.119 0.119
Schistosoma mansoni hypothetical protein 0.0361 0.7956 1
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0265 0.5
Plasmodium vivax SET domain protein, putative 0.0034 0.0349 1
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0265 0.5
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0349 0.0349
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0034 0.0349 0.0349
Loa Loa (eye worm) pigment dispersing factor receptor c 0.006 0.0957 0.0957
Trichomonas vaginalis set domain proteins, putative 0.027 0.5845 0.5
Loa Loa (eye worm) hypothetical protein 0.003 0.0265 0.0265
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0134 0.2682 0.2682
Loa Loa (eye worm) hypothetical protein 0.0034 0.0349 0.0349
Echinococcus multilocularis tar DNA binding protein 0.0134 0.2682 0.2682
Schistosoma mansoni hypothetical protein 0.0361 0.7956 1
Loa Loa (eye worm) TAR-binding protein 0.0134 0.2682 0.2682
Loa Loa (eye worm) hypothetical protein 0.0449 1 1
Brugia malayi hypothetical protein 0.003 0.0265 0.0265
Echinococcus granulosus muscleblind protein 0.0449 1 1
Echinococcus granulosus geminin 0.0361 0.7956 0.7956
Loa Loa (eye worm) hypothetical protein 0.006 0.0957 0.0957
Leishmania major hypothetical protein, conserved 0.003 0.0265 0.5
Brugia malayi RNA recognition motif domain containing protein 0.0134 0.2682 0.2682
Loa Loa (eye worm) hypothetical protein 0.0449 1 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.007 0.119 0.119

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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