TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 278.35 | Formula: C14H22N4O2
H donors: 0 H acceptors: 2 LogP: -0.03 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: O=C(N1CCOCC1)CN1CC(C1)n1nc(cc1C)C
InChi: 1S/C14H22N4O2/c1-11-7-12(2)18(15-11)13-8-16(9-13)10-14(19)17-3-5-20-6-4-17/h7,13H,3-6,8-10H2,1-2H3
InChiKey: SZVBOBAYZCRWLG-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
Loa Loa (eye worm)	ryanodine receptor	0.0064	0.1533	0.2604
Schistosoma mansoni	serine/threonine protein kinase	0.0009	0.0097	0.0097
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0165	0.4156	1
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0016	0.0272	0.0536
Trichomonas vaginalis	mannosyltransferase 1, putative	0.0037	0.0832	0.2001
Loa Loa (eye worm)	hypothetical protein	0.0227	0.5773	0.9807
Brugia malayi	hypothetical protein	0.0011	0.0152	0.0163
Plasmodium falciparum	LCCL domain-containing protein	0.0011	0.0152	0.5
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0165	0.4156	1
Schistosoma mansoni	serine/threonine protein kinase	0.0017	0.0309	0.0309
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0152	0.0259
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0165	0.4156	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0008	0.0084	0.0202
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0009	0.0107	0.0258
Loa Loa (eye worm)	AGC/PKC/ALPHA protein kinase	0.0023	0.046	0.0782
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0012	0.0167	0.0402
Echinococcus multilocularis	ryanodine receptor 44f	0.017	0.4286	0.4286
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0152	0.0259
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0009	0.0107	0.0258
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0008	0.0083	0.0201
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0523	0.0888
Echinococcus multilocularis	Polycystic kidney disease protein	0.0011	0.0152	0.0152
Echinococcus granulosus	ryanodine receptor 44f	0.0132	0.3295	0.3295
Echinococcus multilocularis	protein kinase c epsilon type	0.0009	0.0097	0.0097
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0165	0.4156	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0012	0.0167	0.0402
Schistosoma mansoni	ryanodine receptor related	0.0237	0.6048	0.6048
Schistosoma mansoni	stromal cell-derived factor 2 precursor-like protein	0.0037	0.0832	0.0832
Schistosoma mansoni	inositol 145-trisphosphate receptor	0.0295	0.7557	0.7557
Schistosoma mansoni	microtubule-associated protein tau	0.0389	1	1
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0031	0.0674	0.0674
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0009	0.0097	0.0165
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0009	0.0107	0.0258
Echinococcus granulosus	lipoxygenase domain containing protein	0.0011	0.0152	0.0152
Echinococcus granulosus	geminin	0.0205	0.5193	0.5193
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0016	0.0272	0.0655
Trichomonas vaginalis	PIKK family atypical protein kinase	0.001	0.0129	0.0309
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0016	0.0272	0.0536
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0009	0.0105	0.0253
Schistosoma mansoni	ryanodine receptor 1 skeletal muscle	0.0064	0.1533	0.1533
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0008	0.0084	0.0202
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0165	0.4156	1
Schistosoma mansoni	loxhd1	0.0011	0.0152	0.0152
Schistosoma mansoni	rab6-interacting	0.0011	0.0152	0.0152
Entamoeba histolytica	protein kinase, putative	0.0017	0.0309	0.0095
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0008	0.0083	0.0201
Echinococcus granulosus	stromal cell derived factor 2	0.0037	0.0832	0.0832
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0016	0.0272	0.0655
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0008	0.0083	0.0201
Giardia lamblia	Fructose-bisphosphate aldolase	0.0165	0.4156	1
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0012	0.0167	0.5
Entamoeba histolytica	MIR domain protein	0.0037	0.0832	0.1441
Echinococcus multilocularis	serine threonine protein kinase	0.0028	0.0582	0.0582
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0016	0.0272	0.0272
Schistosoma mansoni	hypothetical protein	0.0205	0.5193	0.5193
Loa Loa (eye worm)	hypothetical protein	0.017	0.4286	0.7281
Schistosoma mansoni	lipoxygenase	0.0031	0.0674	0.0674
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0013	0.0212	0.0511
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0007	0.0056	0.0111
Trypanosoma cruzi	target of rapamycin kinase 3	0.0013	0.0189	0.0372
Trichomonas vaginalis	AGC family protein kinase	0.0017	0.0309	0.0744
Echinococcus granulosus	protein kinase c epsilon type	0.0009	0.0097	0.0097
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0435	0.0739
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0007	0.0033	0.0065
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0165	0.4156	1
Brugia malayi	Protein kinase domain containing protein	0.0017	0.0309	0.0332
Treponema pallidum	fructose-bisphosphate aldolase	0.0165	0.4156	0.5
Echinococcus multilocularis	protein kinase c iota type	0.0008	0.0079	0.0079
Onchocerca volvulus		0.0037	0.0832	1
Brugia malayi	phosphoinositide-dependent protein kinase I	0.0017	0.0309	0.0332
Echinococcus granulosus	3-phosphoinositide-dependent protein kinase 1	0.0017	0.0309	0.0309
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0165	0.4156	1
Echinococcus granulosus	lipoxygenase domain containing protein	0.0011	0.0152	0.0152
Loa Loa (eye worm)	hypothetical protein	0.0193	0.4896	0.8317
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0016	0.0272	0.0272
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0012	0.0167	0.0402
Echinococcus multilocularis	telomerase reverse transcriptase subunit	0.0022	0.0435	0.0435
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0016	0.0272	0.0799
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0012	0.0167	0.0402
Brugia malayi	hypothetical protein	0.0011	0.0152	0.0163
Brugia malayi	Doublecortin family protein	0.0011	0.0152	0.0163
Echinococcus multilocularis	RUN	0.0011	0.0152	0.0152
Brugia malayi	protein kinase C II.	0.0009	0.0097	0.0104
Echinococcus multilocularis	stromal cell derived factor 2	0.0037	0.0832	0.0832
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0012	0.0167	0.0402
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0009	0.0105	0.0253
Schistosoma mansoni	inositol 145-trisphosphate receptor	0.0193	0.4896	0.4896
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0031	0.067	0.067
Brugia malayi	Protein kinase c protein 2	0.0026	0.0548	0.0588
Echinococcus granulosus	ryanodine receptor 44f	0.017	0.4286	0.4286
Schistosoma mansoni	polycystin 1-related	0.0011	0.0152	0.0152
Plasmodium vivax	multidomain scavenger receptor, putative	0.0011	0.0152	0.5
Trypanosoma brucei	inositol 1,4,5-trisphosphate receptor	0.02	0.5079	1
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0016	0.0272	0.0799
Schistosoma mansoni	atypical protein kinase C	0.0008	0.0079	0.0079
Schistosoma mansoni	serine/threonine protein kinase	0.0031	0.067	0.067
Echinococcus granulosus	RUN	0.0011	0.0152	0.0152
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0013	0.0188	0.0453
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0011	0.0137	0.0331
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0016	0.0272	0.0536
Loa Loa (eye worm)	MIR domain-containing protein	0.0037	0.0832	0.1413
Loa Loa (eye worm)	hypothetical protein	0.0231	0.5887	1
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0016	0.0272	0.0536
Schistosoma mansoni	lipoxygenase	0.0011	0.0152	0.0152
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0165	0.4156	1
Echinococcus multilocularis	microtubule associated protein 2	0.0389	1	1
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0016	0.0272	0.0292
Echinococcus granulosus	Protein kinase C brain isozyme	0.0031	0.067	0.067
Schistosoma mansoni	rab6-interacting	0.0011	0.0152	0.0152
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0012	0.0167	0.0402
Trichomonas vaginalis	AGC family protein kinase	0.0017	0.0309	0.0744
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0081	0.196	0.5
Echinococcus multilocularis	3 phosphoinositide dependent protein kinase 1	0.0017	0.0309	0.0309
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0016	0.0272	0.0655
Loa Loa (eye worm)	phosphatidylinositol 3	0.0016	0.0272	0.0462
Loa Loa (eye worm)	AGC/PDK1 protein kinase	0.0017	0.0309	0.0525
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0011	0.0152	0.0152
Schistosoma mansoni	serine/threonine protein kinase	0.0031	0.067	0.067
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0081	0.196	0.5
Echinococcus multilocularis	geminin	0.0205	0.5193	0.5193
Loa Loa (eye worm)	AGC/PDK1 protein kinase	0.0017	0.0309	0.0525
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0165	0.4156	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0013	0.0188	0.0453
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0013	0.0189	0.0554
Echinococcus granulosus	Polycystic kidney disease protein	0.0011	0.0152	0.0152
Brugia malayi	MIR domain containing protein	0.0037	0.0832	0.0893
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0008	0.0084	0.0202
Echinococcus granulosus	protein kinase C gamma type	0.0028	0.0582	0.0582
Schistosoma mansoni	hypothetical protein	0.0205	0.5193	0.5193
Leishmania major	hypothetical protein, conserved	0.0136	0.3409	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0012	0.0167	0.0402
Echinococcus multilocularis	RNA directed DNA polymerase	0.0022	0.0435	0.0435
Trichomonas vaginalis	AGC family protein kinase	0.0017	0.0309	0.0744
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0011	0.0152	0.0152
Loa Loa (eye worm)	doublecortin family protein	0.0011	0.0152	0.0259
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0013	0.0189	0.0372
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0013	0.0188	0.0453
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0008	0.0084	0.0202
Trypanosoma cruzi	inositol 1,4,5-trisphosphate receptor, putative	0.02	0.5079	1
Echinococcus granulosus	protein kinase c iota type	0.0008	0.0079	0.0079
Echinococcus granulosus	RNA directed DNA polymerase	0.0022	0.0435	0.0435
Brugia malayi	cation channel family protein	0.0363	0.9319	1
Echinococcus multilocularis	ryanodine receptor 44f	0.0132	0.3295	0.3295
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0081	0.196	0.5
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0031	0.0674	0.0674
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0013	0.0188	0.0453
Schistosoma mansoni	hypothetical protein	0.0011	0.0152	0.0152
Brugia malayi	Ryanodine Receptor TM 4-6 family protein	0.0237	0.6048	0.649
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0016	0.0272	0.0272
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0165	0.4156	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0013	0.0188	0.0453

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: CHEMBL3496294

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 2069270