TDR Targets

Basic information

Technical information

TDR Targets ID: 841641
Name: N-[4-(4-methoxyphenyl)-1,2,5-oxadiazol-3-yl]- 3-methylbutanamide
MW: 275.303 | Formula: C14H17N3O3
H donors: 1 H acceptors: 3 LogP: 2.16 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(cc1)c1nonc1NC(=O)CC(C)C
InChi: 1S/C14H17N3O3/c1-9(2)8-12(18)15-14-13(16-20-17-14)10-4-6-11(19-3)7-5-10/h4-7,9H,8H2,1-3H3,(H,15,17,18)
InChiKey: LGGUUGLVLDCEER-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-(4-methoxyphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-butanamide
N-[4-(4-methoxyphenyl)furazan-3-yl]-3-methyl-butyramide
STOCK6S-02250
ZINC05451337

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
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0209	0.2427	0.8659
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0088	0.0399	0.0049
Echinococcus granulosus	glycogen phosphorylase	0.0232	0.2802	0.4596
Trypanosoma brucei	RNA helicase, putative	0.0163	0.1645	0.1645
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.0066	0.0019	0.0067
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0091	0.0446	0.0138
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0093	0.0477	0.0477
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0209	0.2427	0.8659
Echinococcus granulosus	glycogen phosphorylase	0.0232	0.2802	0.4596
Schistosoma mansoni	glycogen phosphorylase	0.01	0.0598	0.0378
Loa Loa (eye worm)	phosphotyrosine protein phosphatase	0.0209	0.2427	0.3856
Chlamydia trachomatis	glycogen phosphorylase	0.0232	0.2802	0.5
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0117	0.0878	0.0955
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0402	0.5658	1
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0209	0.2427	0.8296
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	conserved hypothetical protein	0.0087	0.0373	0.1332
Onchocerca volvulus	Glycogen phosphorylase homolog	0.0232	0.2802	1
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0066	0.0019	0.0067
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.0117	0.0878	1
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0087	0.0373	0.1332
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0113	0.0818	0.0818
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0661	1	1
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.0087	0.0373	0.1332
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0087	0.0373	0.0373
Echinococcus multilocularis	glycogen phosphorylase	0.0232	0.2802	0.4596
Schistosoma mansoni	protein tyrosine phosphatase non-receptor type nt1	0.0402	0.5658	0.8888
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0661	1	1
Brugia malayi	carbohydrate phosphorylase	0.0232	0.2802	0.457
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0093	0.0477	0.0477
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.0228	0.2734	0.4466
Entamoeba histolytica	glycogen phosphorylase, putative	0.0232	0.2802	1
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0209	0.2427	0.8296
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0209	0.2427	0.8659
Echinococcus multilocularis	glycogen phosphorylase	0.0232	0.2802	0.4596
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0117	0.0878	0.0955
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0348	0.4756	1
Schistosoma mansoni	glycogen phosphorylase	0.0232	0.2802	0.4085
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0087	0.0373	0.1332
Schistosoma mansoni	memapsin-2 (A01 family)	0.0442	0.6319	1
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0402	0.5658	1
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Trypanosoma brucei	mitochondrial DNA polymerase beta	0.0661	1	1
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0402	0.5658	1
Echinococcus granulosus	Glycosyl transferase family 35	0.0232	0.2802	0.4596
Giardia lamblia	Glycogen phosphorylase	0.0232	0.2802	1
Trypanosoma brucei	DNA polymerase beta thumb, putative	0.0093	0.0477	0.0477
Trichomonas vaginalis	cAMP/cGMP cyclic nucleotide phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0087	0.0373	0.1332
Mycobacterium ulcerans	hypothetical protein	0.0348	0.4756	1
Echinococcus multilocularis	Glycosyl transferase, family 35	0.0232	0.2802	0.4596
Mycobacterium ulcerans	phosphotyrosine protein phosphatase PtpA	0.0209	0.2427	0.4398
Mycobacterium tuberculosis	Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase)	0.0145	0.1345	0.1798
Schistosoma mansoni	glycogen phosphorylase	0.0232	0.2802	0.4085
Loa Loa (eye worm)	hypothetical protein	0.0117	0.0878	0.091
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0087	0.0373	0.0373
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Toxoplasma gondii	hypothetical protein	0.0107	0.0706	0.6024
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0209	0.2427	0.8659
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.0117	0.0878	0.0955
Brugia malayi	Low molecular weight phosphotyrosine protein phosphatase containing protein	0.0209	0.2427	0.3856
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.0087	0.0373	0.1332
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0091	0.0446	0.0446
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative	0.0228	0.2734	0.4439
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.0117	0.0878	0.0848
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0087	0.0373	0.0373
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0313	0.4163	0.4163
Loa Loa (eye worm)	PDE1B protein	0.0228	0.2734	0.4439
Schistosoma mansoni	calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase	0.0228	0.2734	0.397
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0402	0.5658	1
Trichomonas vaginalis	glycogen phosphorylase, putative	0.0232	0.2802	1
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0091	0.0446	0.0138
Leishmania major	cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100	0.0091	0.0446	0.0446
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.0228	0.2734	0.4466
Leishmania major	mitochondrial DNA polymerase beta-PAK, putative	0.0313	0.4163	0.4163
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.0087	0.0373	0.0373
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Entamoeba histolytica	glycogen phosphorylase, putative	0.0232	0.2802	1
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	glycogen phosphorylase, putative	0.0232	0.2802	1
Schistosoma mansoni	hypothetical protein	0.0163	0.1645	0.2139
Loa Loa (eye worm)	glycogen phosphorylase	0.0232	0.2802	0.457
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.0091	0.0446	0.5
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0209	0.2427	0.8659
Giardia lamblia	Low molecular weight protein-tyrosine-phosphatase	0.0209	0.2427	0.8048
Trypanosoma brucei	mitochondrial DNA polymerase beta-PAK	0.0313	0.4163	0.4163
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0117	0.0878	0.0955
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0087	0.0373	0.0373
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.0088	0.0399	0.0049
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.0091	0.0446	0.0446
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0093	0.0477	0.0477
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.0087	0.0373	0.1332
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.0066	0.0019	0.0019
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0209	0.2427	0.8659
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.0087	0.0373	0.1332
Trypanosoma brucei	cAMP phosphodiesterase A, putative	0.0091	0.0446	0.0446

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 841641