TDR Targets

Basic information

Technical information

TDR Targets ID: 877002
Name: 2-[(2,3-dimethylphenyl)amino]-6-propyl-1H-pyr imidin-4-one
MW: 257.331 | Formula: C15H19N3O
H donors: 2 H acceptors: 3 LogP: 3.98 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: CCCc1nc(nc(c1)O)Nc1cccc(c1C)C
InChi: 1S/C15H19N3O/c1-4-6-12-9-14(19)18-15(16-12)17-13-8-5-7-10(2)11(13)3/h5,7-9H,4,6H2,1-3H3,(H2,16,17,18,19)
InChiKey: KXPCFRQTSMBPMI-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

ZINC05214012
ST5324387
Oprea1_580911

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	0.0009	0.0333	0.0333
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0011	0.0464	0.1556
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0464	0.0464
Trypanosoma cruzi	cytochrome P450, putative	0.0013	0.0678	0.5
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0011	0.0464	0.1556
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0011	0.0464	0.0464
Loa Loa (eye worm)	MH1 domain-containing protein	0.0008	0.0197	0.0197
Loa Loa (eye worm)	cytochrome P450 family protein	0.0013	0.0678	0.0678
Echinococcus granulosus	mothers against decapentaplegic 5	0.0008	0.0197	0.0659
Schistosoma mansoni	thyroid hormone receptor	0.0011	0.0464	0.1556
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0011	0.0464	0.1556
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0008	0.0197	0.0659
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0011	0.0464	0.0464
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0011	0.0464	0.1556
Schistosoma mansoni	hypothetical protein	0.0039	0.2985	1
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0011	0.0464	0.1556
Brugia malayi	steroid hormone receptor	0.0011	0.0464	0.0464
Brugia malayi	Smad1	0.0008	0.0197	0.0197
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.0464	0.0464
Loa Loa (eye worm)	CYP4Cod1	0.0013	0.0678	0.0678
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0464	0.0464
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0464	0.0464
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0039	0.2985	1
Trypanosoma brucei	cytochrome P450, putative	0.0013	0.0678	0.5
Entamoeba histolytica	hypothetical protein	0.0039	0.2985	0.5
Brugia malayi	Steroid receptor seven-up type 2	0.0011	0.0464	0.0464
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0011	0.0464	0.0464
Leishmania major	cytochrome p450-like protein	0.0013	0.0678	0.5
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0011	0.0464	0.1556
Echinococcus multilocularis	FTZ F1 alpha	0.0011	0.0464	0.1556
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.0464	0.0464
Schistosoma mansoni	transcription factor LCR-F1	0.0039	0.2985	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0464	0.0464
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.0464	0.1556
Brugia malayi	MH1 domain containing protein	0.0008	0.0197	0.0197
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.0464	0.0464
Brugia malayi	Cytochrome P450 family protein	0.0013	0.0678	0.0678
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.0464	0.1556
Brugia malayi	MH2 domain containing protein	0.0008	0.0197	0.0197
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.0464	0.0464
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0011	0.0464	0.1556
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0008	0.0197	0.0659
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0011	0.0464	0.0464
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0464	0.0464
Echinococcus granulosus	FTZ F1 alpha	0.0011	0.0464	0.1556
Brugia malayi	MH1 domain containing protein	0.0008	0.0197	0.0197
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0011	0.0464	0.0464
Loa Loa (eye worm)	transcription factor SMAD2	0.0116	1	1
Brugia malayi	hypothetical protein	0.0039	0.2985	0.2985
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0464	0.0464
Echinococcus granulosus	smad	0.0008	0.0197	0.0659
Schistosoma mansoni	nuclear hormone receptor	0.0011	0.0464	0.1556
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0011	0.0464	0.0464
Brugia malayi	photoreceptor-specific nuclear receptor	0.0011	0.0464	0.0464
Loa Loa (eye worm)	Smad1	0.0008	0.0197	0.0197
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.0464	0.1556
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0464	0.0464
Loa Loa (eye worm)	steroid hormone receptor	0.0011	0.0464	0.0464
Onchocerca volvulus	Bile acid receptor homolog	0.0011	0.0464	0.5
Schistosoma mansoni	coup transcription factor	0.0011	0.0464	0.1556
Loa Loa (eye worm)	cytochrome P450 family protein	0.0013	0.0678	0.0678
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0011	0.0464	0.0464
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0011	0.0464	0.0464
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0011	0.0464	0.1556
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.0464	0.0464
Echinococcus granulosus	Smad4	0.0008	0.0197	0.0659
Onchocerca volvulus	Protein ultraspiracle homolog	0.0011	0.0464	0.5
Loa Loa (eye worm)	MH2 domain-containing protein	0.0008	0.0197	0.0197
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0011	0.0464	0.5
Brugia malayi	Cytochrome P450 family protein	0.0013	0.0678	0.0678
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0011	0.0464	0.0464
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0011	0.0464	0.0464
Echinococcus multilocularis	Smad4	0.0008	0.0197	0.0659
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0011	0.0464	0.0464
Brugia malayi	nuclear receptor NHR-88	0.0011	0.0464	0.0464
Brugia malayi	MH2 domain containing protein	0.0008	0.0197	0.0197
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0197	0.0659
Entamoeba histolytica	hypothetical protein	0.0039	0.2985	0.5
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0011	0.0464	0.1556
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0464	0.0464
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0011	0.0464	0.1556
Loa Loa (eye worm)	MH2 domain-containing protein	0.0116	1	1
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0013	0.0678	0.5
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0011	0.0464	0.1556
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0011	0.0464	0.1556
Entamoeba histolytica	hypothetical protein	0.0039	0.2985	0.5
Echinococcus granulosus	ecdysone induced protein 78C	0.0011	0.0464	0.1556
Schistosoma mansoni	thyroid hormone receptor	0.0011	0.0464	0.1556
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0011	0.0464	0.1556
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0008	0.0197	0.0659
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0011	0.0464	0.1556
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0197	0.0659
Schistosoma mansoni	Smad4	0.0008	0.0197	0.0659
Echinococcus multilocularis	smad	0.0008	0.0197	0.0659
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0011	0.0464	0.0464
Echinococcus multilocularis	ecdysone induced protein 78C	0.0011	0.0464	0.1556
Schistosoma mansoni	RAR-like nuclear receptor	0.0011	0.0464	0.1556
Brugia malayi	nuclear hormone receptor	0.0011	0.0464	0.0464
Onchocerca volvulus		0.0011	0.0464	0.5
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0011	0.0464	0.0464
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.0464	0.0464
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0039	0.2985	1
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0008	0.0197	0.0659
Brugia malayi	Nuclear hormone receptor-like 1	0.0011	0.0464	0.0464
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0011	0.0464	0.0464
Brugia malayi	ecdysteroid receptor	0.0011	0.0464	0.0464
Schistosoma mansoni	smad	0.0008	0.0197	0.0659
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0011	0.0464	0.1556
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0011	0.0464	0.1556
Trypanosoma cruzi	cytochrome P450, putative	0.0013	0.0678	0.5
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0197	0.0659
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.0464	0.1556
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0011	0.0464	0.1556
Schistosoma mansoni	retinoic acid receptor RXR	0.0011	0.0464	0.1556
Entamoeba histolytica	hypothetical protein	0.0039	0.2985	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 877002