TDR Targets

Basic information

Technical information

TDR Targets ID: 758483
Name: BAS 04996272
MW: 353.418 | Formula: C19H23N5O2
H donors: 1 H acceptors: 2 LogP: 1.12 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CCNC(=O)c1cc2c(n(c1=N)C(CC)C)nc1n(c2=O)cc(cc1)C
InChi: 1S/C19H23N5O2/c1-5-12(4)24-16(20)13(18(25)21-6-2)9-14-17(24)22-15-8-7-11(3)10-23(15)19(14)26/h7-10,12,20H,5-6H2,1-4H3,(H,21,25)
InChiKey: CFEIHLUBIOJPSQ-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)	hypothetical protein	0.0025	0.011	0.0325
Brugia malayi	RNA recognition motif domain containing protein	0.0061	0.2962	0.1933
Loa Loa (eye worm)	TAR-binding protein	0.0061	0.2962	0.8751
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.0046	0.1769	1
Giardia lamblia	GTOR	0.004	0.1276	0.5
Echinococcus multilocularis	FAD linked sulfhydryl oxidase ALR	0.0067	0.3385	0.2417
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.015	1	1
Trypanosoma cruzi	Present in the outer mitochondrial membrane proteome 4	0.0067	0.3385	0.2417
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Leishmania major	hypothetical protein, conserved	0.0067	0.3385	1
Plasmodium vivax	FAD-linked sulfhydryl oxidase ERV1, putative	0.0067	0.3385	0.5
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.004	0.1276	0.356
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Loa Loa (eye worm)	phosphatidylinositol 3	0.004	0.1276	0.3769
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Brugia malayi	TAR-binding protein	0.0061	0.2962	0.1933
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0046	0.1769	0.5481
Echinococcus granulosus	FAD linked sulfhydryl oxidase ALR	0.0067	0.3385	0.2417
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Toxoplasma gondii	target of rapamycin (TOR), putative	0.004	0.1276	0.356
Trypanosoma cruzi	ERV/ALR sulfhydryl oxidase domain-containing protein	0.0067	0.3385	0.2417
Echinococcus multilocularis	tar DNA binding protein	0.0061	0.2962	0.1933
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.2962	0.1933
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.004	0.1276	0.356
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.015	1	1
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.2962	0.1933
Trypanosoma brucei	ERV/ALR sulfhydryl oxidase domain-containing protein	0.0067	0.3385	1
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.2962	0.1933
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.004	0.1276	0.356
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.015	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.015	1	1
Trypanosoma cruzi	Present in the outer mitochondrial membrane proteome 4	0.0067	0.3385	0.2417
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0063	0.3137	0.9244
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Toxoplasma gondii	Erv1 / Alr family protein	0.0067	0.3385	1
Toxoplasma gondii	Erv1 / Alr family protein	0.0067	0.3385	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Loa Loa (eye worm)	hepatopoietin HPO2	0.0067	0.3385	1
Brugia malayi	RNA binding protein	0.0061	0.2962	0.1933
Loa Loa (eye worm)	RNA binding protein	0.0061	0.2962	0.8751
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.2962	0.1933
Plasmodium falciparum	FAD-linked sulfhydryl oxidase ERV1, putative	0.0067	0.3385	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0063	0.3137	0.8826
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0061	0.2962	0.8751
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0063	0.3137	1
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.004	0.1276	0.356
Loa Loa (eye worm)	phosphatidylinositol 3	0.0063	0.3137	0.9268
Brugia malayi	Augmenter of liver regeneration	0.0067	0.3385	0.2417
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.2962	0.1933
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Trichomonas vaginalis	PIKK family atypical protein kinase	0.004	0.1276	0.3851
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.015	1	1
Echinococcus granulosus	tar DNA binding protein	0.0061	0.2962	0.1933

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

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 758483