TDR Targets

Basic information

Technical information

TDR Targets ID: 739201
Name: 2-(4-methylphenoxy)-N-[[3-(3-methylphenyl)-1, 2,4-oxadiazol-5-yl]methyl]acetamide
MW: 337.372 | Formula: C19H19N3O3
H donors: 1 H acceptors: 3 LogP: 3.38 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: O=C(NCc1onc(n1)c1cccc(c1)C)COc1ccc(cc1)C
InChi: 1S/C19H19N3O3/c1-13-6-8-16(9-7-13)24-12-17(23)20-11-18-21-19(22-25-18)15-5-3-4-14(2)10-15/h3-10H,11-12H2,1-2H3,(H,20,23)
InChiKey: QRJIKOYCBZKNGJ-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

2-(4-methylphenoxy)-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamide
ZINC06743998

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
Brugia malayi	Latrophilin receptor protein 2	0.0031	0.0081	0.1086
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0031	0.0081	0.0357
Plasmodium falciparum	beta-ketoacyl-ACP synthase III	0.1413	0.4622	1
Plasmodium vivax	beta-ketoacyl-acyl carrier protein synthase III precursor, putative	0.1413	0.4622	1
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0053	0.0155	0.1767
Schistosoma mansoni	ap endonuclease	0.0018	0.004	0.0171
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0081	0.1081
Entamoeba histolytica	fatty acid elongase, putative	0.0183	0.0582	1
Schistosoma mansoni	amine oxidase	0.0215	0.0685	0.3095
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0098	0.0301	0.4333
Echinococcus granulosus	dnaJ subfamily B	0.0402	0.13	0.5885
Schistosoma mansoni	microtubule-associated protein tau	0.0678	0.2208	1
Brugia malayi	SWIRM domain containing protein	0.0215	0.0685	1
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0215	0.0685	0.3095
Echinococcus multilocularis	cpg binding protein	0.003	0.0077	0.034
Mycobacterium ulcerans	protoporphyrinogen oxidase	0.0215	0.0685	0.0648
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0215	0.0685	1
Schistosoma mansoni	hypothetical protein	0.0031	0.0081	0.0357
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0098	0.0301	0.4336
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0031	0.0081	0.0357
Entamoeba histolytica	fatty acid elongase, putative	0.0183	0.0582	1
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0215	0.0685	1
Schistosoma mansoni	Lysine-specific histone demethylase 1	0.0215	0.0685	0.3095
Loa Loa (eye worm)	hypothetical protein	0.0215	0.0685	1
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0031	0.0081	0.0357
Mycobacterium ulcerans	3-oxoacyl-ACP synthase	0.1413	0.4622	0.4601
Loa Loa (eye worm)	hypothetical protein	0.0215	0.0685	1
Onchocerca volvulus		0.0215	0.0685	1
Echinococcus multilocularis	microtubule associated protein 2	0.0678	0.2208	1
Schistosoma mansoni	Protoporphyrinogen oxidase chloroplast/mitochondrial precursor	0.0215	0.0685	0.3095
Mycobacterium ulcerans	oxidoreductase	0.0215	0.0685	0.0648
Schistosoma mansoni	hypothetical protein	0.0031	0.0081	0.0357
Mycobacterium ulcerans	monoamine oxidase	0.0215	0.0685	0.0648
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0018	0.004	0.0171
Toxoplasma gondii	histone lysine-specific demethylase LSD1/BHC110/KDMA1A	0.0216	0.069	1
Schistosoma mansoni	hypothetical protein	0.0402	0.13	0.5885
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0018	0.004	0.0473
Trichomonas vaginalis	ap endonuclease, putative	0.0018	0.004	1
Mycobacterium tuberculosis	Possible oxidoreductase	0.0215	0.0685	0.0697
Brugia malayi	latrophilin 2 splice variant baaae	0.0067	0.0199	0.2831
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0018	0.004	0.0171
Brugia malayi	hypothetical protein	0.0215	0.0685	1
Plasmodium falciparum	lysine-specific histone demethylase 1, putative	0.0215	0.0685	0.1407
Mycobacterium leprae	PROBABLE PROTOPORPHYRINOGEN OXIDASE HEMY (PROTOPORPHYRINOGEN-IX OXIDASE) (PROTOPORPHYRINOGENASE) (PPO)	0.0215	0.0685	0.5
Mycobacterium ulcerans	beta-ketoacyl synthase-like protein	0.1413	0.4622	0.4601
Schistosoma mansoni	hypothetical protein	0.0031	0.0081	0.0357
Schistosoma mansoni	cpg binding protein	0.003	0.0077	0.034
Schistosoma mansoni	ap endonuclease	0.0018	0.004	0.0171
Echinococcus multilocularis	dnaJ subfamily B	0.0402	0.13	0.5885
Entamoeba histolytica	fatty acid elongase, putative	0.0183	0.0582	1
Mycobacterium tuberculosis	Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO)	0.2834	0.9294	1
Echinococcus multilocularis		0.0215	0.0685	0.3095
Echinococcus granulosus	microtubule associated protein 2	0.0678	0.2208	1
Plasmodium vivax	hypothetical protein, conserved	0.0215	0.0685	0.1407
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0031	0.0081	0.1081
Mycobacterium ulcerans	3-oxoacyl-ACP synthase	0.1413	0.4622	0.4601
Loa Loa (eye worm)	hypothetical protein	0.0215	0.0685	1
Entamoeba histolytica	fatty acid elongase, putative	0.0183	0.0582	1
Toxoplasma gondii	histone lysine-specific demethylase	0.0215	0.0685	0.9913
Echinococcus multilocularis	protoporphyrinogen oxidase	0.0215	0.0685	0.3095
Entamoeba histolytica	fatty acid elongase, putative	0.0183	0.0582	1
Plasmodium vivax	lysine-specific histone demethylase 1, putative	0.0215	0.0685	0.1407
Loa Loa (eye worm)	hypothetical protein	0.0215	0.0685	1
Schistosoma mansoni	cpg binding protein	0.003	0.0077	0.034
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0008	0.0026
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.3049	1	1
Loa Loa (eye worm)	hypothetical protein	0.0215	0.0685	1
Brugia malayi	exodeoxyribonuclease III family protein	0.0018	0.004	0.0478
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0031	0.0081	0.0357
Brugia malayi	amine oxidase, flavin-containing family protein	0.0215	0.0685	1
Leishmania major	UDP-galactopyranose mutase	0.0215	0.0685	1
Schistosoma mansoni	cpg binding protein	0.0028	0.0072	0.0316
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0098	0.0301	0.4336
Echinococcus multilocularis	GPCR, family 2	0.0031	0.0081	0.0357
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0008	0.0026
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0215	0.0685	0.3095
Mycobacterium ulcerans	dehydrogenase	0.0215	0.0685	0.0648
Schistosoma mansoni	amine oxidase	0.0215	0.0685	0.3095
Loa Loa (eye worm)	hypothetical protein	0.0098	0.0301	0.4333
Echinococcus granulosus	GPCR family 2	0.0031	0.0081	0.0357
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0199	0.2828
Plasmodium falciparum	protoporphyrinogen oxidase	0.0215	0.0685	0.1407
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0215	0.0685	0.0697
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0018	0.004	0.5
Wolbachia endosymbiont of Brugia malayi	3-oxoacyl-ACP synthase	0.1413	0.4622	1
Loa Loa (eye worm)	hypothetical protein	0.0215	0.0685	1
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.0072	0.0946
Mycobacterium tuberculosis	3-oxoacyl-[acyl-carrier-protein] synthase III FabH (beta-ketoacyl-ACP synthase III) (KAS III)	0.1413	0.4622	0.4952
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0215	0.0685	0.1407
Chlamydia trachomatis	oxoacyl-ACP synthase III	0.1413	0.4622	1
Plasmodium vivax	hypothetical protein, conserved	0.0215	0.0685	0.1407
Echinococcus multilocularis	lysine specific histone demethylase 1A	0.0215	0.0685	0.3095
Schistosoma mansoni	hypothetical protein	0.0067	0.0199	0.0894
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0018	0.004	0.5
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0018	0.004	0.5
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.006	0.0176	0.0788
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0031	0.0081	0.1086
Plasmodium vivax	protoporphyrinogen oxidase, putative	0.0215	0.0685	0.1407
Brugia malayi	CXXC zinc finger family protein	0.0028	0.0072	0.0951
Trichomonas vaginalis	ap endonuclease, putative	0.0018	0.004	1
Echinococcus granulosus	cpg binding protein	0.003	0.0077	0.034
Schistosoma mansoni	hypothetical protein	0.0031	0.0081	0.0357

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 739201