TDR Targets

Basic information

Technical information

TDR Targets ID: 795117
Name: 5-(2-methylpropyl)-N-[2-(trifluoromethyl)phen yl]-1,2-oxazole-3-carboxamide
MW: 312.287 | Formula: C15H15F3N2O2
H donors: 1 H acceptors: 2 LogP: 4.05 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CC(Cc1onc(c1)C(=O)Nc1ccccc1C(F)(F)F)C
InChi: 1S/C15H15F3N2O2/c1-9(2)7-10-8-13(20-22-10)14(21)19-12-6-4-3-5-11(12)15(16,17)18/h3-6,8-9H,7H2,1-2H3,(H,19,21)
InChiKey: BVIANHXDCDQYCC-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

5-isobutyl-N-[2-(trifluoromethyl)phenyl]isoxazole-3-carboxamide
5-isobutyl-N-[2-(trifluoromethyl)phenyl]-3-isoxazolecarboxamide

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	norepinephrine/norepinephrine transporter	0.0046	0.0751	0.0539
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0024	0.0287	1
Onchocerca volvulus		0.0061	0.1076	0.0812
Onchocerca volvulus		0.0046	0.0751	0.0478
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0061	0.1076	0.1192
Echinococcus granulosus	tar DNA binding protein	0.0066	0.119	0.1421
Schistosoma mansoni	sodium/chloride dependent transporter	0.0046	0.0751	0.0539
Schistosoma mansoni	hypothetical protein	0.0177	0.3536	0.614
Toxoplasma gondii	Sodium:neurotransmitter symporter family protein	0.0046	0.0751	0.698
Onchocerca volvulus		0.0268	0.5455	0.5321
Echinococcus granulosus	geminin	0.0177	0.3536	0.614
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase/rotamase, putative	0.0032	0.0467	0.1571
Echinococcus granulosus	uncharacterized sodium dependent transporter	0.0046	0.0751	0.0539
Echinococcus granulosus	uncharacterized sodium dependent transporter	0.0046	0.0751	0.0539
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0046	0.0751	0.0539
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0061	0.1076	0.1192
Plasmodium falciparum	amino acid transporter, putative	0.0046	0.0751	1
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0268	0.5455	0.6099
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0046	0.0751	0.0539
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0046	0.0751	0.0548
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0059	0.1028	0.1097
Brugia malayi	Pre-SET motif family protein	0.0061	0.1076	0.0931
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0032	0.0467	0.1571
Plasmodium vivax	amine transporter, putative	0.0046	0.0751	0.6448
Onchocerca volvulus		0.0099	0.1873	0.1633
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, putative	0.0032	0.0467	0.067
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0024	0.0287	1
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0061	0.1076	1
Brugia malayi	Pre-SET motif family protein	0.0425	0.8761	1
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0046	0.0751	0.0548
Plasmodium falciparum	transporter, putative	0.0046	0.0751	1
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.119	0.1421
Schistosoma mansoni	sodium/chloride dependent transporter	0.0046	0.0751	0.0539
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.119	0.1421
Entamoeba histolytica	Acid sphingomyelinase-like phosphodiesterase, putative	0.0086	0.1615	0.4951
Brugia malayi	RNA binding protein	0.0066	0.119	0.1066
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0287	0.6146
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0024	0.0287	1
Brugia malayi	RNA recognition motif domain containing protein	0.0066	0.119	0.1066
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0425	0.8761	1
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0024	0.0287	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0061	0.1076	0.1192
Mycobacterium ulcerans	hypothetical protein	0.0024	0.0287	1
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0046	0.0751	0.0539
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0024	0.0287	1
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0751	0.0686
Echinococcus granulosus	sodium and chloride dependent glycine	0.0046	0.0751	0.0539
Echinococcus multilocularis	sodium:chloride dependent neurotransmitter	0.0046	0.0751	0.0539
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0099	0.1873	0.2795
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0061	0.1076	0.1192
Loa Loa (eye worm)	hypothetical protein	0.0099	0.1873	0.1991
Echinococcus granulosus	sodium and chloride dependent glycine	0.0046	0.0751	0.0539
Treponema pallidum	sodium- and chloride- dependent transporter	0.0268	0.5455	0.5
Schistosoma mansoni	hypothetical protein	0.0054	0.0933	0.0904
Echinococcus multilocularis	tar DNA binding protein	0.0066	0.119	0.1421
Toxoplasma gondii	peptidylprolyl isomerase	0.0032	0.0467	0.4337
Echinococcus granulosus	histone lysine methyltransferase setb	0.0061	0.1076	0.1192
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0018	0.0161	0.139
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0751	0.0686
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0751	0.0686
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0046	0.0751	0.0548
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0751	0.0686
Leishmania major	peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative	0.0032	0.0467	1
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase NIMA-interacting 4, putative	0.0151	0.297	1
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.119	0.1421
Loa Loa (eye worm)	solute carrier family 6 member 4	0.0268	0.5455	0.6156
Echinococcus granulosus	serotonin transporter	0.0268	0.5455	1
Brugia malayi	Trypsin family protein	0.0099	0.1873	0.1872
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0061	0.1076	0.1192
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0099	0.1873	0.2795
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.119	0.1421
Wolbachia endosymbiont of Brugia malayi	parvulin-like peptidyl-prolyl isomerase, PPID	0.001	0	0.5
Brugia malayi	Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1	0.0033	0.0483	0.0231
Brugia malayi	TAR-binding protein	0.0066	0.119	0.1066
Echinococcus multilocularis	geminin	0.0177	0.3536	0.614
Loa Loa (eye worm)	hypothetical protein	0.0151	0.297	0.3266
Onchocerca volvulus		0.0046	0.0751	0.0478
Echinococcus multilocularis	serotonin transporter	0.0268	0.5455	1
Loa Loa (eye worm)	hypothetical protein	0.0151	0.297	0.3266
Trichomonas vaginalis	rotamase, putative	0.0033	0.0483	0.0017
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0287	1
Brugia malayi	hypothetical protein	0.0046	0.0751	0.0548
Loa Loa (eye worm)	hypothetical protein	0.0268	0.5455	0.6156
Toxoplasma gondii	hypothetical protein	0.0046	0.0751	0.698
Loa Loa (eye worm)	hypothetical protein	0.0268	0.5455	0.6156
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0061	0.1076	0.1192
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0066	0.119	0.1196
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0046	0.0751	0.0539
Loa Loa (eye worm)	RNA binding protein	0.0066	0.119	0.1196
Trichomonas vaginalis	conserved hypothetical protein	0.0033	0.0483	0.0017
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0287	0.5
Loa Loa (eye worm)	serotonin transporter b	0.0268	0.5455	0.6156
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0751	0.0686
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0024	0.0287	1
Toxoplasma gondii	hypothetical protein	0.0046	0.0751	0.698
Loa Loa (eye worm)	Sodium:neurotransmitter symporter family protein	0.0046	0.0751	0.0686
Echinococcus granulosus	peptidyl prolyl cis trans isomerase	0.0151	0.297	0.5001
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0287	0.5
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0287	0.0146
Brugia malayi	Sodium:neurotransmitter symporter family protein 1, putative	0.0046	0.0751	0.0548
Echinococcus multilocularis	sodium and chloride dependent glycine	0.0046	0.0751	0.0539
Loa Loa (eye worm)	TAR-binding protein	0.0066	0.119	0.1196
Onchocerca volvulus		0.0046	0.0751	0.0478
Trichomonas vaginalis	set domain proteins, putative	0.0483	1	1
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase NIMA-interacting 4, putative	0.0151	0.297	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0287	0.6146
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0287	0.6146
Echinococcus multilocularis	uncharacterized sodium dependent transporter	0.0046	0.0751	0.0539
Loa Loa (eye worm)	hypothetical protein	0.0061	0.1076	0.1064
Loa Loa (eye worm)	Sodium:neurotransmitter symporter family protein	0.0046	0.0751	0.0686
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0751	0.0686
Plasmodium vivax	hypothetical protein, conserved	0.0046	0.0751	0.6448
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0287	1
Echinococcus granulosus	sodium:chloride dependent neurotransmitter	0.0046	0.0751	0.0539
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0287	0.0146
Schistosoma mansoni	hypothetical protein	0.0177	0.3536	0.614
Plasmodium vivax	SET domain protein, putative	0.0061	0.1076	1
Toxoplasma gondii	Sodium:neurotransmitter symporter family protein	0.0046	0.0751	0.698
Loa Loa (eye worm)	hypothetical protein	0.0268	0.5455	0.6156
Toxoplasma gondii	Sodium:neurotransmitter symporter family protein	0.0046	0.0751	0.698
Schistosoma mansoni	sodium/chloride dependent transporter	0.0268	0.5455	1
Brugia malayi	parvulin-type peptidyl-prolyl cis-trans isomerase, Bm parvulin	0.0151	0.297	0.3166
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0046	0.0751	0.0539
Echinococcus multilocularis	sodium dependent neurotransmitter transporter	0.0046	0.0751	0.0539
Loa Loa (eye worm)	Pin1-type peptidyl-prolyl cis-trans isomerase	0.0033	0.0483	0.0374
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0287	0.0146
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0032	0.0467	0.1571
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase NIMA-interacting 4, putative	0.0151	0.297	1
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0268	0.5455	1
Entamoeba histolytica	Acid sphingomyelinase-like phosphodiesterase, putative	0.0086	0.1615	0.4951
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0046	0.0751	0.0539
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0287	1
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0046	0.0751	0.0539
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0751	0.0686
Loa Loa (eye worm)	hypothetical protein	0.0086	0.1615	0.1691
Schistosoma mansoni	sodium-dependent amino acid transporter	0.0046	0.0751	0.0539
Loa Loa (eye worm)	norepinephrine transporter	0.0268	0.5455	0.6156
Onchocerca volvulus		0.0092	0.1737	0.1493
Echinococcus granulosus	sodium dependent neurotransmitter transporter	0.0046	0.0751	0.0539
Chlamydia trachomatis	Ssodium-dependent amino acid transporter	0.0046	0.0751	1
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.119	0.1421
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, putative	0.0151	0.297	1
Loa Loa (eye worm)	hypothetical protein	0.0099	0.1873	0.1991
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase	0.0151	0.297	0.5001
Echinococcus multilocularis	sodium and chloride dependent glycine	0.0046	0.0751	0.0539

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 795117