TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 240.343 | Formula: C16H20N2
H donors: 1 H acceptors: 0 LogP: 3.33 Rotable bonds: 1
Rule of 5 violations (Lipinski): 1
SMILES: C1CCN(C1)C1CCc2c(C1)c1ccccc1[nH]2
InChi: 1S/C16H20N2/c1-2-6-15-13(5-1)14-11-12(7-8-16(14)17-15)18-9-3-4-10-18/h1-2,5-6,12,17H,3-4,7-11H2
InChiKey: LOEZCSXETJMUNC-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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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

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0248	0.1332	0.1332
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0209	0.1057	0.1057
Onchocerca volvulus	Glycogen phosphorylase homolog	0.007	0.0076	0.0226
Entamoeba histolytica	glycogen phosphorylase, putative	0.007	0.0076	1
Echinococcus granulosus	ectonucleotide	0.0209	0.1057	0.1057
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0248	0.1332	0.1332
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0248	0.1332	0.1332
Trypanosoma cruzi	endonuclease G, putative	0.0149	0.0635	1
Echinococcus granulosus	Glycosyl transferase family 35	0.007	0.0076	0.0076
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0209	0.1057	0.1057
Schistosoma mansoni	protein tyrosine phosphatase non-receptor type nt1	0.1478	1	1
Leishmania major	DNA/RNA non-specific endonuclease-like protein	0.0149	0.0635	1
Brugia malayi	carbohydrate phosphorylase	0.007	0.0076	0.0076
Onchocerca volvulus		0.0248	0.1332	0.397
Echinococcus multilocularis	Endonuclease G	0.0149	0.0635	0.0635
Loa Loa (eye worm)	hypothetical protein	0.0248	0.1332	0.1332
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0248	0.1332	0.1332
Trypanosoma brucei	endonuclease G, putative	0.0149	0.0635	1
Schistosoma mansoni	protein tyrosine phosphatase n11 (shp2)	0.0134	0.0531	0.0531
Giardia lamblia	Glycogen phosphorylase	0.007	0.0076	1
Trichomonas vaginalis	glycogen phosphorylase, putative	0.007	0.0076	1
Brugia malayi	endonuclease G, mitochondrial precursor	0.0149	0.0635	0.0635
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0248	0.1332	0.1332
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0248	0.1332	0.1332
Entamoeba histolytica	glycogen phosphorylase, putative	0.007	0.0076	1
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0248	0.1332	0.1332
Toxoplasma gondii	DNA/RNA non-specific endonuclease	0.0149	0.0635	0.5
Trichomonas vaginalis	glycogen phosphorylase, putative	0.007	0.0076	1
Loa Loa (eye worm)	hypothetical protein	0.0248	0.1332	0.1332
Schistosoma mansoni	glycogen phosphorylase	0.007	0.0076	0.0076
Trypanosoma cruzi	DNA/RNA non-specific endonuclease protein-like, putative	0.0149	0.0635	1
Echinococcus granulosus	glycogen phosphorylase	0.007	0.0076	0.0076
Loa Loa (eye worm)	glycogen phosphorylase	0.007	0.0076	0.0076
Onchocerca volvulus		0.0535	0.3355	1
Echinococcus multilocularis	ectonucleotide	0.0209	0.1057	0.1057
Echinococcus multilocularis	glycogen phosphorylase	0.007	0.0076	0.0076
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0134	0.0531	0.0531
Schistosoma mansoni	endonuclease related	0.0149	0.0635	0.0635
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0248	0.1332	0.1332
Brugia malayi	Thrombospondin type 1 domain containing protein	0.0535	0.3355	0.3355
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0248	0.1332	0.1332
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0134	0.0531	0.0531
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0134	0.0531	0.0531
Brugia malayi	Type I phosphodiesterase / nucleotide pyrophosphatase family protein	0.0248	0.1332	0.1332
Loa Loa (eye worm)	hypothetical protein	0.0248	0.1332	0.1332
Onchocerca volvulus		0.0248	0.1332	0.397
Trypanosoma cruzi	DNA/RNA non-specific endonuclease protein-like, putative	0.0149	0.0635	1
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0248	0.1332	0.1332
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0134	0.0531	0.0531
Loa Loa (eye worm)	hypothetical protein	0.0209	0.1057	0.1057
Schistosoma mansoni	glycogen phosphorylase	0.007	0.0076	0.0076
Echinococcus multilocularis	Glycosyl transferase, family 35	0.007	0.0076	0.0076
Trypanosoma brucei	endonuclease G, putative	0.0149	0.0635	1
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.1478	1	1
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0248	0.1332	0.1332
Leishmania major	endonuclease G, putative	0.0149	0.0635	1
Echinococcus granulosus	Endonuclease G	0.0149	0.0635	0.0635
Trypanosoma cruzi	endonuclease G, putative	0.0149	0.0635	1
Schistosoma mansoni	hypothetical protein	0.0535	0.3355	0.3355
Chlamydia trachomatis	glycogen phosphorylase	0.007	0.0076	0.5
Trypanosoma brucei	endonuclease G, putative	0.0149	0.0635	1
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0134	0.0531	0.0531
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0248	0.1332	0.1332
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0248	0.1332	0.1332
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0248	0.1332	0.1332
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0248	0.1332	0.1332
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.1478	1	1
Echinococcus granulosus	glycogen phosphorylase	0.007	0.0076	0.0076
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0134	0.0531	0.0531
Loa Loa (eye worm)	thrombospondin type 1 domain-containing protein	0.0535	0.3355	0.3355
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.1478	1	1
Echinococcus multilocularis	glycogen phosphorylase	0.007	0.0076	0.0076

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

ChEMBL: CHEMBL3273297

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1914572