TDR Targets

Basic information

Technical information

TDR Targets ID: 648440
Name: 2-[5-(4-propylphenyl)-1,2,4-oxadiazol-3-yl]py ridine
MW: 265.31 | Formula: C16H15N3O
H donors: 0 H acceptors: 3 LogP: 3.77 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: CCCc1ccc(cc1)c1onc(n1)c1ccccn1
InChi: 1S/C16H15N3O/c1-2-5-12-7-9-13(10-8-12)16-18-15(19-20-16)14-6-3-4-11-17-14/h3-4,6-11H,2,5H2,1H3
InChiKey: MYROAMCGAIDSMN-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

SP 00713
Oprea1_234500
BIM-0041659.P001
ZINC00114089
CBMicro_041851

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
Plasmodium vivax	glutathione reductase, putative	0.0076	0.1257	1
Plasmodium vivax	hypothetical protein, conserved	0.0072	0.1174	0.9262
Onchocerca volvulus		0.0072	0.1174	0.0932
Loa Loa (eye worm)	hypothetical protein	0.0072	0.1174	0.934
Mycobacterium tuberculosis	Probable oxidoreductase	0.0193	0.3899	0.3818
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0122	0.2298	1
Schistosoma mansoni	bromodomain containing protein	0.0063	0.096	0.1583
Trypanosoma brucei	trypanothione reductase	0.0076	0.1257	1
Leishmania major	hypothetical protein, conserved	0.0072	0.1174	0.4809
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0193	0.3899	0.3818
Mycobacterium tuberculosis	Conserved protein	0.0072	0.1174	0.1056
Leishmania major	trypanothione reductase	0.0076	0.1257	0.5192
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.005	0.0678	0.5397
Mycobacterium tuberculosis	Probable lipase LipD	0.0072	0.1174	0.1056
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.0678	0.1119
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0173	0.3461	0.8393
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0036	0.0344	0.0809
Schistosoma mansoni	scm-relatedprotein containing 4 mbt domains (sfmbt)	0.0047	0.0609	0.1005
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0122	0.2298	0.2195
Mycobacterium tuberculosis	Probable hydrolase	0.0072	0.1174	0.1056
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0193	0.3899	1
Echinococcus multilocularis	endonuclease exonuclease phosphatase	0.0187	0.3766	1
Schistosoma mansoni	hypothetical protein	0.0288	0.6061	1
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0609	0.4848
Brugia malayi	mbt repeat family protein	0.0047	0.0609	0.442
Entamoeba histolytica	hypothetical protein	0.004	0.0434	0.5
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0122	0.2298	0.6057
Trichomonas vaginalis	D-aminoacylase, putative	0.0072	0.1174	1
Echinococcus multilocularis	histone acetyltransferase MYST2	0.0054	0.0758	0.192
Brugia malayi	Thioredoxin reductase	0.0076	0.1257	1
Mycobacterium tuberculosis	Probable reductase	0.0173	0.3461	0.3374
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0026	0.0132	0.5
Schistosoma mansoni	aldehyde dehydrogenase	0.0122	0.2298	0.3791
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0059	0.0879	0.2246
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0122	0.2298	0.6057
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0072	0.1174	0.1936
Loa Loa (eye worm)	beta-lactamase	0.0072	0.1174	0.934
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0399	0.3177
Onchocerca volvulus		0.0315	0.6667	1
Mycobacterium ulcerans	lipase LipD	0.0072	0.1174	0.4809
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0122	0.2298	1
Loa Loa (eye worm)	hypothetical protein	0.0072	0.1174	0.934
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0026	0.0132	0.0308
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0122	0.2298	1
Plasmodium falciparum	thioredoxin reductase	0.0076	0.1257	1
Onchocerca volvulus		0.0072	0.1174	0.0932
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0072	0.1174	0.1056
Loa Loa (eye worm)	hypothetical protein	0.0072	0.1174	0.934
Schistosoma mansoni	aldehyde dehydrogenase	0.0122	0.2298	0.3791
Loa Loa (eye worm)	hypothetical protein	0.0072	0.1174	0.934
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0122	0.2298	1
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0072	0.1174	0.1056
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0072	0.1174	0.1056
Entamoeba histolytica	hypothetical protein	0.004	0.0434	0.5
Mycobacterium ulcerans	esterase/lipase LipP	0.0072	0.1174	0.4809
Mycobacterium tuberculosis	Conserved protein	0.0072	0.1174	0.1056
Mycobacterium tuberculosis	Probable lipase LipE	0.0072	0.1174	0.1056
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0193	0.3899	0.3818
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0036	0.0344	0.0809
Schistosoma mansoni	hypothetical protein	0.004	0.0434	0.0716
Giardia lamblia	NADH oxidase lateral transfer candidate	0.0026	0.0132	0.5
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.004	0.0434	0.1051
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.005	0.0678	0.1706
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0076	0.1257	0.114
Entamoeba histolytica	hypothetical protein	0.004	0.0434	0.5
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0072	0.1174	0.1936
Mycobacterium tuberculosis	Conserved protein	0.0072	0.1174	0.1056
Schistosoma mansoni	transcription factor LCR-F1	0.004	0.0434	0.0716
Loa Loa (eye worm)	hypothetical protein	0.0072	0.1174	0.934
Trypanosoma cruzi	hypothetical protein, conserved	0.0072	0.1174	0.9262
Schistosoma mansoni	myelin transcription factor 1 myt1	0.0054	0.0758	0.125
Echinococcus granulosus	polycomb protein SCMH1	0.0047	0.0609	0.1521
Echinococcus granulosus	beta LACTamase domain containing family member	0.0072	0.1174	0.3037
Echinococcus granulosus	SAM and MBT domain containing protein	0.0047	0.0609	0.1521
Plasmodium vivax	thioredoxin reductase, putative	0.0076	0.1257	1
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.0026	0.0132	0.0239
Brugia malayi	hypothetical protein	0.004	0.0434	0.2913
Mycobacterium ulcerans	hypothetical protein	0.0072	0.1174	0.4809
Trypanosoma cruzi	hypothetical protein, conserved	0.0072	0.1174	0.9262
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.0678	0.1119
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.0026	0.0132	0.0239
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0059	0.0879	0.2246
Brugia malayi	glutathione reductase	0.0076	0.1257	1
Echinococcus multilocularis	SAM and MBT domain containing protein	0.0047	0.0609	0.1521
Trichomonas vaginalis	esterase, putative	0.0072	0.1174	1
Treponema pallidum	NADH oxidase	0.0026	0.0132	0.5
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0173	0.3461	0.3374
Loa Loa (eye worm)	thioredoxin reductase	0.0076	0.1257	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.005	0.0678	0.5015
Trichomonas vaginalis	penicillin-binding protein, putative	0.0072	0.1174	1
Mycobacterium ulcerans	beta-lactamase	0.0072	0.1174	0.4809
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.0026	0.0132	0.5
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.005	0.0678	0.1706
Loa Loa (eye worm)	glutathione reductase	0.0076	0.1257	1
Toxoplasma gondii	ABC1 family protein	0.0072	0.1174	0.4809
Trypanosoma brucei	hypothetical protein, conserved	0.0072	0.1174	0.9262
Trichomonas vaginalis	D-aminoacylase, putative	0.0072	0.1174	1
Loa Loa (eye worm)	hypothetical protein	0.0072	0.1174	0.934
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.0678	0.1119
Echinococcus granulosus	endonuclease exonuclease phosphatase	0.0187	0.3766	1
Toxoplasma gondii	aldehyde dehydrogenase	0.0122	0.2298	1
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0758	0.603
Trichomonas vaginalis	penicillin-binding protein, putative	0.0072	0.1174	1
Brugia malayi	C2-HC type zinc finger protein C.e-MyT1	0.0054	0.0758	0.5701
Brugia malayi	beta-lactamase	0.0072	0.1174	0.9285
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.005	0.0678	0.1706
Plasmodium falciparum	glutathione reductase	0.0076	0.1257	1
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0072	0.1174	0.4809
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.0026	0.0132	0.0218
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.004	0.0434	0.1051
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.0026	0.0132	0.5
Trypanosoma cruzi	trypanothione reductase, putative	0.0076	0.1257	1
Schistosoma mansoni	sex comb on midleg homolog	0.0047	0.0609	0.1005
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0077	0.128	0.3322
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0072	0.1174	0.3037
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0072	0.1174	0.9285
Trichomonas vaginalis	D-aminoacylase, putative	0.0072	0.1174	1
Echinococcus multilocularis	polycomb protein SCMH1	0.0047	0.0609	0.1521
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0495	0.3943
Brugia malayi	Bromodomain containing protein	0.0038	0.0398	0.2597
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0173	0.3461	0.3374
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.005	0.0678	0.1706
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0173	0.3461	0.3374
Entamoeba histolytica	hypothetical protein	0.004	0.0434	0.5
Brugia malayi	Bromodomain containing protein	0.0075	0.1223	0.9715
Echinococcus granulosus	histone acetyltransferase MYST2	0.0054	0.0758	0.192
Brugia malayi	beta-lactamase family protein	0.0072	0.1174	0.9285
Loa Loa (eye worm)	mbt repeat family protein	0.0047	0.0609	0.4848
Loa Loa (eye worm)	hypothetical protein	0.007	0.1127	0.8971
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0173	0.3461	0.3374
Loa Loa (eye worm)	MBCTL1	0.0054	0.0758	0.603
Brugia malayi	beta-lactamase family protein	0.0072	0.1174	0.9285
Mycobacterium tuberculosis	Probable esterase LipL	0.0072	0.1174	0.1056
Toxoplasma gondii	thioredoxin reductase	0.0076	0.1257	0.5192
Schistosoma mansoni	sex comb on midleg homolog	0.0047	0.0609	0.1005
Loa Loa (eye worm)	hypothetical protein	0.004	0.0452	0.3601
Echinococcus multilocularis	suppression of tumorigenicity 18 protein	0.0054	0.0758	0.192
Echinococcus granulosus	suppression of tumorigenicity 18 protein	0.0054	0.0758	0.192
Mycobacterium tuberculosis	Probable dehydrogenase	0.0173	0.3461	0.3374
Echinococcus granulosus	thioredoxin glutathione reductase	0.0077	0.128	0.3322
Onchocerca volvulus		0.0072	0.1174	0.0932
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0072	0.1174	0.934
Brugia malayi	mbt repeat family protein	0.0047	0.0609	0.442
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0022	0.0043	0.0071

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 648440