TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 451.518 | Formula: C24H29N5O4
H donors: 1 H acceptors: 3 LogP: 1.47 Rotable bonds: 11
Rule of 5 violations (Lipinski): 1
SMILES: C=CCOc1ccccc1CN1CCn2c(CC1)nnc2CNC(=O)c1ccc(o1)COC
InChi: 1S/C24H29N5O4/c1-3-14-32-20-7-5-4-6-18(20)16-28-11-10-22-26-27-23(29(22)13-12-28)15-25-24(30)21-9-8-19(33-21)17-31-2/h3-9H,1,10-17H2,2H3,(H,25,30)
InChiKey: KITUGHTXUHMPOA-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
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Toxoplasma gondii	C2 domain-containing protein	0.0055	0	0.5
Leishmania major	c2 domain protein, putative	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Toxoplasma gondii	hypothetical protein	0.0055	0	0.5
Entamoeba histolytica	C2 domain containing protein	0.0055	0	0.5
Plasmodium vivax	hypothetical protein, conserved	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Entamoeba histolytica	hypothetical protein	0.0055	0	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0055	0	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0062	1	1
Leishmania major	hypothetical protein, conserved	0.0055	0	0.5
Trypanosoma brucei	C2 domain containing protein, putative	0.0055	0	0.5
Trypanosoma cruzi	synaptotagmin, putative	0.0055	0	0.5
Plasmodium vivax	ferlin, putative	0.0055	0	0.5
Leishmania major	hypothetical protein, conserved	0.0055	0	0.5
Leishmania major	hypothetical protein, conserved	0.0055	0	0.5
Trypanosoma brucei	C2 domain containing protein, putative	0.0055	0	0.5
Entamoeba histolytica	hypothetical protein, conserved	0.0055	0	0.5
Trichomonas vaginalis	Circumsporozoite protein precursor, putative	0.0055	0	0.5
Trichomonas vaginalis	copine, putative	0.0055	0	0.5
Entamoeba histolytica	C2 domain containing protein	0.0055	0	0.5
Brugia malayi	TAR-binding protein	0.0062	1	1
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0062	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trypanosoma brucei	cAMP binding protein, putative	0.0055	0	0.5
Trypanosoma brucei	hypothetical protein, conserved	0.0055	0	0.5
Entamoeba histolytica	DENN domain protein	0.0055	0	0.5
Trichomonas vaginalis	annexin VII, putative	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	synaptotagmin, putative	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	synaptotagmin, putative	0.0055	0	0.5
Trypanosoma brucei	Coiled-coil and C2 domain-containing protein	0.0055	0	0.5
Onchocerca volvulus		0.0055	0	0.5
Leishmania major	c2 domain protein, putative	0.0055	0	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0055	0	0.5
Onchocerca volvulus	Multiple C2 domain and transmembrane region protein homolog	0.0055	0	0.5
Entamoeba histolytica	C2 domain containing protein	0.0055	0	0.5
Onchocerca volvulus		0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Plasmodium falciparum	ferlin, putative	0.0055	0	0.5
Trypanosoma cruzi	C2 domain containing protein, putative	0.0055	0	0.5
Plasmodium vivax	double C2-like domain-containing protein, putative	0.0055	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0055	0	0.5
Trichomonas vaginalis	calcium-dependent lipid-binding protein, putative	0.0055	0	0.5
Trypanosoma brucei	C2 domain containing protein, putative	0.0055	0	0.5
Entamoeba histolytica	hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	copine, putative	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Entamoeba histolytica	C2 domain containing protein	0.0055	0	0.5
Trypanosoma brucei	predicted C2 domain protein	0.0055	0	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0062	1	1
Trichomonas vaginalis	synaptotagmin 1,2, putative	0.0055	0	0.5
Toxoplasma gondii	ferlin family protein	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Toxoplasma gondii	hypothetical protein	0.0055	0	0.5
Entamoeba histolytica	C2 domain containing protein	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trypanosoma cruzi	phosphoinositide-specific phospholipase C, putative	0.0055	0	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0055	0	0.5
Entamoeba histolytica	calcium-binding protein, putative	0.0055	0	0.5
Onchocerca volvulus		0.0055	0	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0055	0	0.5
Onchocerca volvulus		0.0055	0	0.5
Plasmodium falciparum	ferlin, putative	0.0055	0	0.5
Entamoeba histolytica	C2 domain containing protein	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Toxoplasma gondii	Elicitor-responsive protein, putative	0.0055	0	0.5
Plasmodium falciparum	double C2-like domain-containing protein	0.0055	0	0.5
Trichomonas vaginalis	synaptotagmin, putative	0.0055	0	0.5
Trypanosoma brucei	C2 domain/Ankyrin repeats (3 copies), putative	0.0055	0	0.5
Onchocerca volvulus		0.0055	0	0.5
Echinococcus granulosus	tar DNA binding protein	0.0062	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trypanosoma brucei	predicted C2 domain protein	0.0055	0	0.5
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0055	0	0.5
Entamoeba histolytica	hypothetical protein	0.0055	0	0.5
Entamoeba histolytica	C2 domain protein, putative	0.0055	0	0.5
Entamoeba histolytica	hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Onchocerca volvulus		0.0055	0	0.5
Trypanosoma cruzi	cytoskeleton associated protein, putative	0.0055	0	0.5
Leishmania major	phospholipase c-like protein	0.0055	0	0.5
Trichomonas vaginalis	copine, putative	0.0055	0	0.5
Entamoeba histolytica	hypothetical protein	0.0055	0	0.5
Toxoplasma gondii	Sma protein	0.0055	0	0.5
Plasmodium vivax	ferlin, putative	0.0055	0	0.5
Brugia malayi	RNA recognition motif domain containing protein	0.0062	1	1
Onchocerca volvulus		0.0055	0	0.5
Trichomonas vaginalis	copine, putative	0.0055	0	0.5
Trichomonas vaginalis	vab10 spectraplakin, putative	0.0055	0	0.5
Trichomonas vaginalis	splicing factor 3A subunit, putative	0.0055	0	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0062	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Entamoeba histolytica	protein kinase, putative	0.0055	0	0.5
Trypanosoma brucei	C2 domain containing protein, putative	0.0055	0	0.5
Leishmania major	hypothetical protein, conserved	0.0055	0	0.5
Trichomonas vaginalis	synaptotagmin, putative	0.0055	0	0.5
Entamoeba histolytica	hypothetical protein	0.0055	0	0.5
Toxoplasma gondii	hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Onchocerca volvulus		0.0055	0	0.5
Trypanosoma cruzi	hypothetical protein, conserved	0.0055	0	0.5
Toxoplasma gondii	phosphoinositide phospholipase PIPLC	0.0055	0	0.5
Echinococcus multilocularis	tar DNA binding protein	0.0062	1	1
Onchocerca volvulus	Putative cc2d1b protein	0.0055	0	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0062	1	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0055	0	0.5
Trichomonas vaginalis	synaptotagmin 1, 3, C.elegans, putative	0.0055	0	0.5
Trypanosoma cruzi	cytoskeleton associated protein, putative	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Entamoeba histolytica	hypothetical protein, conserved	0.0055	0	0.5
Trypanosoma cruzi	Coiled-coil and C2 domain-containing protein	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trypanosoma brucei	hypothetical protein, conserved	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	Proline-rich protein, putative	0.0055	0	0.5
Trypanosoma brucei	phosphoinositide-specific phospholipase C	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	synaptotagmin 1,2, putative	0.0055	0	0.5
Trichomonas vaginalis	synaptotagmin, putative	0.0055	0	0.5
Trypanosoma cruzi	C2 domain/Ankyrin repeats (3 copies), putative	0.0055	0	0.5
Leishmania major	hypothetical protein, conserved	0.0055	0	0.5
Leishmania major	hypothetical protein, conserved	0.0055	0	0.5
Leishmania major	hypothetical protein, conserved	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Loa Loa (eye worm)	TAR-binding protein	0.0062	1	1
Trichomonas vaginalis	copine, putative	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Loa Loa (eye worm)	RNA binding protein	0.0062	1	1
Entamoeba histolytica	C2 domain containing protein	0.0055	0	0.5
Trichomonas vaginalis	synaptotagmin 1,2, putative	0.0055	0	0.5
Entamoeba histolytica	Rap/Ran GTPase activating protein, putative	0.0055	0	0.5
Trichomonas vaginalis	synaptotagmin 1, 3, C.elegans, putative	0.0055	0	0.5
Entamoeba histolytica	C2 domain containing protein	0.0055	0	0.5
Trypanosoma brucei	predicted C2 domain protein	0.0055	0	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0062	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Trichomonas vaginalis	synaptotagmin, putative	0.0055	0	0.5
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0055	0	0.5
Trichomonas vaginalis	synaptotagmin, putative	0.0055	0	0.5
Trypanosoma cruzi	synaptotagmin, putative	0.0055	0	0.5
Trypanosoma cruzi	cAMP binding protein, putative	0.0055	0	0.5
Entamoeba histolytica	C2 domain containing protein	0.0055	0	0.5
Leishmania major	hypothetical protein, conserved	0.0055	0	0.5
Trichomonas vaginalis	ion channel nompc, putative	0.0055	0	0.5
Trypanosoma brucei	synaptotagmin, putative	0.0055	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0055	0	0.5
Leishmania major	copine i-like protein	0.0055	0	0.5

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 814060