TDR Targets

Basic information

Technical information

TDR Targets ID: 864597
Name: 3-(2-methoxy-5-methylphenyl)-5-[3-(2-methylph enyl)-1,2,4-oxadiazol-5-yl]triazol-4-amine
MW: 362.385 | Formula: C19H18N6O2
H donors: 1 H acceptors: 4 LogP: 3.28 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(cc1n1nnc(c1N)c1onc(n1)c1ccccc1C)C
InChi: 1S/C19H18N6O2/c1-11-8-9-15(26-3)14(10-11)25-17(20)16(22-24-25)19-21-18(23-27-19)13-7-5-4-6-12(13)2/h4-10H,20H2,1-3H3
InChiKey: SZUNTLDYDHUTGM-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

3-(2-methoxy-5-methyl-phenyl)-5-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]triazol-4-amine
3-(2-methoxy-5-methylphenyl)-5-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-4-triazolamine
[3-(2-methoxy-5-methyl-phenyl)-5-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]triazol-4-yl]amine
3-(2-methoxy-5-methyl-phenyl)-5-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-1,2,3-triazol-4-amine

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	histone-lysine n-methyltransferase setb1	0.003	0.0026	0.0017
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.0081	0.1243	0.1656
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.6283	1
Brugia malayi	Proteasome A-type and B-type family protein	0.0081	0.1243	0.2891
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.6283	1
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0144	0.2719	1
Echinococcus granulosus	jumonji domain containing protein	0.0041	0.0282	0.0282
Trypanosoma cruzi	proteasome subunit beta type-5, putative	0.0081	0.1243	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0026	0.0017
Plasmodium falciparum	proteasome subunit beta type-2, putative	0.0039	0.0243	0.1892
Echinococcus granulosus	proteasome prosome macropain subunit beta	0.0039	0.0243	0.0243
Plasmodium falciparum	proteasome subunit beta type-5	0.0081	0.1243	1
Onchocerca volvulus		0.003	0.0026	0.0034
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0036	0.0156	0.0146
Toxoplasma gondii	proteasome subunit beta type 2, putative	0.0039	0.0243	0.1892
Plasmodium falciparum	proteasome subunit beta type-1, putative	0.0063	0.0813	0.6512
Echinococcus multilocularis	jumonji domain containing protein	0.0041	0.0282	0.0273
Toxoplasma gondii	proteasome subunit beta type 1, putative	0.0063	0.0813	0.6512
Brugia malayi	jmjC domain containing protein	0.0096	0.1591	0.3706
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0294	0.6283	1
Plasmodium vivax	SET domain protein, putative	0.003	0.0026	0.0135
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.003	0.0026	0.0017
Loa Loa (eye worm)	hypothetical protein	0.005	0.0506	0.0497
Brugia malayi	hypothetical protein	0.0207	0.4227	0.9884
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0036	0.0156	0.0146
Leishmania major	proteasome beta 5 subunit, putative	0.0081	0.1243	1
Schistosoma mansoni	proteasome catalytic subunit 3 (T01 family)	0.0081	0.1243	0.1235
Giardia lamblia	Proteasome subunit beta type 5 precursor	0.0081	0.1243	0.1967
Echinococcus multilocularis	proteasome (prosome, macropain) subunit, beta	0.0063	0.0813	0.0804
Brugia malayi	Pre-SET motif family protein	0.0209	0.4277	1
Trypanosoma cruzi	proteasome beta 6 subunit, putative	0.0063	0.0813	0.5699
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.003	0.0026	0.0017
Schistosoma mansoni	leukotriene A4 hydrolase (M01 family)	0.0451	1	1
Loa Loa (eye worm)	proteasome A-type and B-type family protein	0.0081	0.1243	0.1235
Echinococcus granulosus	peregrin	0.0029	0.001	0.001
Echinococcus multilocularis	lysine specific demethylase 5A	0.0036	0.0156	0.0146
Trypanosoma brucei	proteasome subunit beta type-5, putative	0.0081	0.1243	1
Loa Loa (eye worm)	proteasome subunit beta type 1	0.0063	0.0813	0.0804
Entamoeba histolytica	proteasome subunit beta type 1, putative	0.0063	0.0813	0.0944
Giardia lamblia	Proteasome subunit beta type 1	0.0063	0.0813	0.1281
Brugia malayi	Pre-SET motif family protein	0.003	0.0026	0.0039
Plasmodium vivax	proteasome subunit beta type-2, putative	0.0039	0.0243	0.1892
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.003	0.0026	0.0017
Brugia malayi	proteasome subunit beta type 1	0.0063	0.0813	0.1883
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.6283	1
Leishmania major	proteasome beta 6 subunit, putative,20S proteasome beta 6 subunit, putative	0.0063	0.0813	0.5699
Echinococcus multilocularis	leukotriene A 4 hydrolase	0.0451	1	1
Treponema pallidum	fructose-bisphosphate aldolase	0.0294	0.6283	0.5
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.6283	1
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0096	0.1591	0.1591
Schistosoma mansoni	proteasome subunit beta 2 (T01 family)	0.0039	0.0243	0.0234
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.6283	1
Echinococcus granulosus	geminin	0.0171	0.3355	0.3355
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0144	0.2719	1
Schistosoma mansoni	proteasome subunit beta 1 (T01 family)	0.0063	0.0813	0.0804
Schistosoma mansoni	hypothetical protein	0.0171	0.3355	0.3348
Loa Loa (eye worm)	jmjC domain-containing protein	0.0036	0.0156	0.0146
Toxoplasma gondii	proteasome subunit beta type, putative	0.0081	0.1243	1
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.003	0.0026	0.0135
Onchocerca volvulus		0.0238	0.4962	1
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0294	0.6283	1
Loa Loa (eye worm)	hypothetical protein	0.003	0.0026	0.0017
Brugia malayi	proteasome subunit beta type 2	0.0039	0.0243	0.0547
Plasmodium vivax	proteasome subunit beta type-1, putative	0.0063	0.0813	0.6512
Schistosoma mansoni	jumonji domain containing protein	0.0076	0.1123	0.1115
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0096	0.1591	0.1583
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0026	0.0017
Brugia malayi	jmjC domain containing protein	0.0036	0.0156	0.0343
Loa Loa (eye worm)	jmjC domain-containing protein	0.0061	0.075	0.0741
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.0063	0.0813	0.0944
Trypanosoma brucei	proteasome beta 6 subunit	0.0063	0.0813	0.5699
Echinococcus multilocularis	geminin	0.0171	0.3355	0.3348
Echinococcus granulosus	lysine specific demethylase 5A	0.0036	0.0156	0.0156
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0144	0.2719	1
Echinococcus granulosus	proteasome prosome macropain	0.0081	0.1243	0.1243
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.6283	1
Trypanosoma cruzi	proteasome subunit beta type-5, putative	0.0081	0.1243	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.6283	1
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0209	0.4277	0.4271
Entamoeba histolytica	proteasome subunit beta type 5 precursor, putative	0.0081	0.1243	0.1656
Loa Loa (eye worm)	leukotriene A4 hydrolase	0.0451	1	1
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0294	0.6283	1
Echinococcus multilocularis	proteasome (prosome, macropain) subunit, beta	0.0039	0.0243	0.0234
Schistosoma mansoni	proteasome subunit beta 2 (T01 family)	0.0039	0.0243	0.0234
Loa Loa (eye worm)	proteasome subunit beta type 2	0.0039	0.0243	0.0234
Trypanosoma cruzi	proteasome beta 6 subunit, putative	0.0063	0.0813	0.5699
Echinococcus granulosus	PHD finger protein rhinoceros	0.0029	0.001	0.001
Giardia lamblia	Proteasome subunit beta type 2	0.0039	0.0243	0.0372
Echinococcus granulosus	proteasome prosome macropain subunit beta	0.0063	0.0813	0.0813
Echinococcus multilocularis	proteasome (prosome, macropain)	0.0081	0.1243	0.1235
Trichomonas vaginalis	set domain proteins, putative	0.0238	0.4962	0.7813
Giardia lamblia	Fructose-bisphosphate aldolase	0.0294	0.6283	1
Plasmodium vivax	proteasome subunit beta type-5, putative	0.0081	0.1243	1
Echinococcus granulosus	histone lysine methyltransferase setb	0.003	0.0026	0.0026
Schistosoma mansoni	hypothetical protein	0.0171	0.3355	0.3348

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 864597