TDR Targets

Basic information

Technical information

TDR Targets ID: 847052
Name: N-(4-ethoxyphenyl)-5-methyl-1-[3-(trifluorome thyl)phenyl]triazole-4-carboxamide
MW: 390.359 | Formula: C19H17F3N4O2
H donors: 1 H acceptors: 3 LogP: 4.14 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CCOc1ccc(cc1)NC(=O)c1nnn(c1C)c1cccc(c1)C(F)(F)F
InChi: 1S/C19H17F3N4O2/c1-3-28-16-9-7-14(8-10-16)23-18(27)17-12(2)26(25-24-17)15-6-4-5-13(11-15)19(20,21)22/h4-11H,3H2,1-2H3,(H,23,27)
InChiKey: MWLHAGDEGFLIFG-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

N-(4-ethoxyphenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-4-triazolecarboxamide
N-(4-ethoxyphenyl)-5-methyl-1-[3-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxamide
ZINC04315603

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
Schistosoma mansoni	alkaline phosphatase	0.0657	1	1
Brugia malayi	RNA binding protein	0.013	0.1773	1
Schistosoma mansoni	hypothetical protein	0.0341	0.5073	0.507
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0241	0.1328
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0015	0.0046
Loa Loa (eye worm)	MH2 domain-containing protein	0.0121	0.1626	0.9172
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0032	0.0241	0.1328
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0032	0.0241	0.0235
Schistosoma mansoni	alkaline phosphatase	0.0657	1	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0032	0.0241	0.1328
Brugia malayi	ecdysteroid receptor	0.0032	0.0241	0.1328
Brugia malayi	nuclear receptor NHR-88	0.0032	0.0241	0.1328
Schistosoma mansoni	tar DNA-binding protein	0.013	0.1773	0.1767
Schistosoma mansoni	tar DNA-binding protein	0.013	0.1773	0.1767
Echinococcus multilocularis	ecdysone induced protein 78C	0.0032	0.0241	0.0235
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0106	0.0565
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0032	0.0241	0.1328
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0032	0.0241	0.1328
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0032	0.0241	0.0235
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0241	0.1328
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0032	0.0241	0.0235
Entamoeba histolytica	hypothetical protein	0.0041	0.0391	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0032	0.0241	0.0235
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0015	0.0046
Echinococcus granulosus	microtubule associated protein 2	0.0621	0.9444	0.9444
Echinococcus multilocularis	tar DNA binding protein	0.013	0.1773	0.1767
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0032	0.0241	0.1328
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0032	0.0241	0.0235
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0032	0.0241	0.1328
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0106	0.5
Onchocerca volvulus	Protein ultraspiracle homolog	0.0032	0.0241	1
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0106	0.0565
Mycobacterium ulcerans	dTDP-6-deoxy-L-lyxo-4-hexulose reductase RmlD	0.0218	0.3147	1
Brugia malayi	Steroid receptor seven-up type 2	0.0032	0.0241	0.1328
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0041	0.0391	0.0384
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0032	0.0241	0.1328
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0032	0.0241	0.1328
Echinococcus multilocularis	alkaline phosphatase	0.0657	1	1
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0032	0.0241	0.1328
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0106	0.0565
Schistosoma mansoni	thyroid hormone receptor	0.0032	0.0241	0.0235
Echinococcus granulosus	ecdysone induced protein 78C	0.0032	0.0241	0.0235
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0032	0.0241	0.0235
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0241	0.1328
Loa Loa (eye worm)	transcription factor SMAD2	0.0121	0.1626	0.9172
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0106	0.0565
Loa Loa (eye worm)	TAR-binding protein	0.013	0.1773	1
Echinococcus multilocularis	intestinal type alkaline phosphatase 1	0.0657	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0032	0.0241	0.1328
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0241	0.1328
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0.0106	0.0338
Schistosoma mansoni	microtubule-associated protein tau	0.0621	0.9444	0.9444
Brugia malayi	MH2 domain containing protein	0.0121	0.1626	0.9172
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0032	0.0241	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0032	0.0241	0.1328
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0032	0.0241	0.1328
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0032	0.0241	0.1328
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0241	0.1328
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0032	0.0241	0.1328
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0032	0.0241	0.0235
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0106	0.5
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0106	0.0292
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0032	0.0241	0.0235
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0106	0.0565
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0032	0.0241	0.0235
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0015	0.0046
Mycobacterium tuberculosis	dTDP-6-deoxy-L-lyxo-4-hexulose reductase RmlD (dTDP-rhamnose modification protein) (dTDP-rhamnose biosynthesis protein) (dTDP-rh	0.0218	0.3147	1
Entamoeba histolytica	hypothetical protein	0.0041	0.0391	1
Schistosoma mansoni	retinoic acid receptor RXR	0.0032	0.0241	0.0235
Echinococcus granulosus	geminin	0.0173	0.2443	0.2438
Schistosoma mansoni	coup transcription factor	0.0032	0.0241	0.0235
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0032	0.0241	0.0235
Onchocerca volvulus		0.0032	0.0241	1
Echinococcus multilocularis	FTZ F1 alpha	0.0032	0.0241	0.0235
Plasmodium falciparum	acyl-CoA synthetase	0.0017	0.0015	0.5
Mycobacterium leprae	dTDP-6-deoxy-L-lyxo-4-hexulose reductase RmlD (dTDP-RHAMNOSE MODIFICATION PROTEIN) (dTDP-RHAMNOSE BIOSYNTHESIS PROTEIN) (dTDP-RH	0.0151	0.2099	1
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0241	0.1328
Brugia malayi	photoreceptor-specific nuclear receptor	0.0032	0.0241	0.1328
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0032	0.0241	0.1328
Loa Loa (eye worm)	steroid hormone receptor	0.0032	0.0241	0.1328
Brugia malayi	TAR-binding protein	0.013	0.1773	1
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0015	0.0046
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.013	0.1773	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0032	0.0241	0.1328
Entamoeba histolytica	hypothetical protein	0.0041	0.0391	1
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0241	0.1328
Trichomonas vaginalis	NAD dependent epimerase/dehydratase, putative	0.0218	0.3147	0.5
Schistosoma mansoni	thyroid hormone receptor	0.0032	0.0241	0.0235
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0032	0.0241	0.1328
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0032	0.0241	0.1328
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0106	0.0292
Wolbachia endosymbiont of Brugia malayi	nucleoside-diphosphate-sugar epimerase	0.0067	0.0792	0.5
Echinococcus multilocularis	geminin	0.0173	0.2443	0.2438
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0032	0.0241	0.0235
Plasmodium vivax	acyl-CoA synthetase, putative	0.0017	0.0015	0.5
Schistosoma mansoni	hypothetical protein	0.0041	0.0391	0.0384
Onchocerca volvulus	Bile acid receptor homolog	0.0032	0.0241	1
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0.0106	0.0338
Brugia malayi	nuclear hormone receptor	0.0032	0.0241	0.1328
Brugia malayi	steroid hormone receptor	0.0032	0.0241	0.1328
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0032	0.0241	0.0235
Echinococcus granulosus	intestinal type alkaline phosphatase 1	0.0657	1	1
Schistosoma mansoni	hypothetical protein	0.0173	0.2443	0.2438
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0032	0.0241	0.1328
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0032	0.0241	0.1328
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0017	0.0015	0.5
Schistosoma mansoni	tar DNA-binding protein	0.013	0.1773	0.1767
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0032	0.0241	0.1328
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0041	0.0391	0.0384
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0032	0.0241	0.0235
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0106	0.0565
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0032	0.0241	0.0235
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0015	0.0046
Schistosoma mansoni	tar DNA-binding protein	0.013	0.1773	0.1767
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	0.0106	0.0292
Echinococcus granulosus	FTZ F1 alpha	0.0032	0.0241	0.0235
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0032	0.0241	0.0235
Brugia malayi	RNA recognition motif domain containing protein	0.013	0.1773	1
Echinococcus granulosus	alkaline phosphatase intestinal gene 2	0.0657	1	1
Echinococcus multilocularis	intestinal type alkaline phosphatase	0.0657	1	1
Entamoeba histolytica	hypothetical protein	0.0041	0.0391	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0106	0.0292
Mycobacterium ulcerans	hypothetical protein	0.0023	0.0106	0.0292
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0106	0.5
Echinococcus multilocularis	microtubule associated protein 2	0.0621	0.9444	0.9444
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0241	0.1328
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	0.0106	0.0292
Echinococcus multilocularis	alkaline phosphatase, intestinal, gene 2	0.0657	1	1
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0032	0.0241	0.0235
Loa Loa (eye worm)	RNA binding protein	0.013	0.1773	1
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	0.0106	0.0292
Schistosoma mansoni	transcription factor LCR-F1	0.0041	0.0391	0.0384
Schistosoma mansoni	nuclear hormone receptor	0.0032	0.0241	0.0235
Echinococcus granulosus	alkaline phosphatase	0.0657	1	1
Brugia malayi	hypothetical protein	0.0041	0.0391	0.2174
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0032	0.0241	0.0235
Echinococcus granulosus	tar DNA binding protein	0.013	0.1773	0.1767
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0017	0.0015	0.0047
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0032	0.0241	0.0235
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0032	0.0241	0.0235
Schistosoma mansoni	tar DNA-binding protein	0.013	0.1773	0.1767
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0032	0.0241	0.0235
Schistosoma mansoni	hypothetical protein	0.0173	0.2443	0.2438
Schistosoma mansoni	RAR-like nuclear receptor	0.0032	0.0241	0.0235
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0032	0.0241	0.0235
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	0.0106	0.0292

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 847052