Detailed information for compound 864597

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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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

Obtained from network model

Ranking Plot


Putative Targets List


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

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

Bibliographic References

No literature references available for this target.

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