Detailed information for compound 899176

Basic information

Technical information
  • TDR Targets ID: 899176
  • Name: 3-(3-fluorophenyl)-5-(3-phenyl-1,2,4-oxadiazo l-5-yl)triazol-4-amine
  • MW: 322.297 | Formula: C16H11FN6O
  • H donors: 1 H acceptors: 4 LogP: 2.68 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Fc1cccc(c1)n1nnc(c1N)c1onc(n1)c1ccccc1
  • InChi: 1S/C16H11FN6O/c17-11-7-4-8-12(9-11)23-14(18)13(20-22-23)16-19-15(21-24-16)10-5-2-1-3-6-10/h1-9H,18H2
  • InChiKey: GFKJXAUIKITRJO-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 3-(3-fluorophenyl)-5-(3-phenyl-1,2,4-oxadiazol-5-yl)-4-triazolamine
  • [3-(3-fluorophenyl)-5-(3-phenyl-1,2,4-oxadiazol-5-yl)triazol-4-yl]amine
  • 3-(3-fluorophenyl)-5-(3-phenyl-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
Loa Loa (eye worm) cytochrome P450 family protein 0.0037 0.1024 0.1024
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0038 0.1092 0.5
Trypanosoma brucei glucosidase, putative 0.0038 0.1092 0.0425
Mycobacterium tuberculosis Probable cytochrome P450 monooxygenase 142 Cyp142 0.0037 0.1024 0.5
Loa Loa (eye worm) CYP4Cod1 0.0072 0.2641 0.2641
Echinococcus granulosus survival motor neuron protein 1 0.0233 1 1
Mycobacterium tuberculosis Probable cytochrome P450 141 Cyp141 0.0037 0.1024 0.5
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.1092 0.5
Loa Loa (eye worm) cytochrome P450 family protein 0.0072 0.2641 0.2641
Mycobacterium tuberculosis Probable cytochrome P450 144 Cyp144 0.0037 0.1024 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 0.0967 0.0967
Mycobacterium tuberculosis Probable cytochrome P450 132 Cyp132 0.0037 0.1024 0.5
Leishmania major alpha glucosidase II subunit, putative 0.0038 0.1092 0.0425
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.1092 0.5
Trichomonas vaginalis neutral alpha-glucosidase ab precursor, putative 0.0038 0.1092 0.5
Schistosoma mansoni alpha-glucosidase 0.0148 0.611 1
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.1092 0.0425
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0172 0.7204 0.7204
Echinococcus granulosus cytochrome P450 2K1 0.0037 0.1024 0.0487
Mycobacterium tuberculosis Cytochrome P450 121 Cyp121 0.0037 0.1024 0.5
Toxoplasma gondii glycosyl hydrolase, family 31 protein 0.0038 0.1092 1
Mycobacterium tuberculosis Probable cytochrome P450 136 Cyp136 0.0037 0.1024 0.5
Loa Loa (eye worm) hypothetical protein 0.0026 0.0542 0.0542
Brugia malayi Glycosyl hydrolases family 31 protein 0.0038 0.1092 0.1092
Schistosoma mansoni hypothetical protein 0.0037 0.1024 0.0829
Echinococcus multilocularis neutral alpha glucosidase AB 0.0038 0.1092 0.056
Mycobacterium tuberculosis Probable cytochrome P450 139 Cyp139 0.0037 0.1024 0.5
Mycobacterium leprae putative cytochrome p450 0.0037 0.1024 0.5
Mycobacterium leprae Conserved hypothetical protein 0.0037 0.1024 0.5
Echinococcus granulosus neutral alpha glucosidase AB 0.0038 0.1092 0.056
Brugia malayi Glycosyl hydrolases family 31 protein 0.0172 0.7204 0.7204
Mycobacterium tuberculosis Probable cytochrome P450 130 Cyp130 0.0037 0.1024 0.5
Brugia malayi Intermediate filament tail domain containing protein 0.0027 0.0564 0.0564
Mycobacterium tuberculosis Probable cytochrome P450 123 Cyp123 0.0037 0.1024 0.5
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0027 0.0564 0.0564
Mycobacterium tuberculosis Possible cytochrome P450 126 Cyp126 0.0037 0.1024 0.5
Mycobacterium tuberculosis Probable cytochrome P450 137 Cyp137 0.0037 0.1024 0.5
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.1092 0.5
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.1092 0.5
Echinococcus multilocularis lysosomal alpha glucosidase 0.0172 0.7204 0.7037
Entamoeba histolytica glycosyl hydrolase, family 31 protein 0.0038 0.1092 0.5
Loa Loa (eye worm) cytochrome P450 family protein 0.0072 0.2641 0.2641
Brugia malayi Cytochrome P450 family protein 0.0072 0.2641 0.2641
Trichomonas vaginalis sucrase-isomaltase, putative 0.0038 0.1092 0.5
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0038 0.1092 0.1092
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0048 0.1522 0.1522
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.1092 0.5
Brugia malayi intermediate filament protein 0.0027 0.0564 0.0564
Brugia malayi Cytochrome P450 family protein 0.0037 0.1024 0.1024
Mycobacterium tuberculosis Probable cytochrome P450 124 Cyp124 0.0037 0.1024 0.5
Schistosoma mansoni alpha glucosidase 0.0038 0.1092 0.0953
Mycobacterium tuberculosis Probable cytochrome P450 125 Cyp125 0.0037 0.1024 0.5
Brugia malayi cytochrome P450 0.0037 0.1024 0.1024
Mycobacterium tuberculosis Probable cytochrome P450 143 Cyp143 0.0037 0.1024 0.5
Echinococcus multilocularis survival motor neuron protein 1 0.0233 1 1
Schistosoma mansoni alpha-glucosidase 0.0148 0.611 1
Brugia malayi Cytochrome P450 family protein 0.0037 0.1024 0.1024
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.1092 0.0425
Schistosoma mansoni survival motor neuron protein 0.0048 0.1522 0.1727
Loa Loa (eye worm) hypothetical protein 0.0027 0.0564 0.0564
Leishmania major cytochrome p450-like protein 0.0072 0.2641 1
Brugia malayi Cytochrome P450 family protein 0.0072 0.2641 0.2641
Trypanosoma cruzi cytochrome P450, putative 0.0072 0.2641 1
Mycobacterium tuberculosis Probable cytochrome P450 140 Cyp140 0.0037 0.1024 0.5
Loa Loa (eye worm) hypothetical protein 0.0233 1 1
Mycobacterium tuberculosis Probable cytochrome P450 128 Cyp128 0.0037 0.1024 0.5
Echinococcus multilocularis 0.0037 0.1024 0.0487
Mycobacterium tuberculosis Possible cytochrome P450 135B1 Cyp135B1 0.0037 0.1024 0.5
Mycobacterium tuberculosis Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM) 0.0037 0.1024 0.5
Echinococcus multilocularis lysosomal alpha glucosidase 0.0172 0.7204 0.7037
Mycobacterium tuberculosis Probable cytochrome P450 138 Cyp138 0.0037 0.1024 0.5
Schistosoma mansoni hypothetical protein 0.0048 0.1522 0.1727
Onchocerca volvulus 0.0048 0.1522 0.2878
Trichomonas vaginalis alpha-glucosidase, putative 0.0038 0.1092 0.5
Onchocerca volvulus 0.0099 0.3892 1
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0072 0.2641 1
Echinococcus granulosus lysosomal alpha glucosidase 0.0172 0.7204 0.7037
Loa Loa (eye worm) cytochrome P450 0.0037 0.1024 0.1024
Trypanosoma brucei cytochrome P450, putative 0.0072 0.2641 1
Trichomonas vaginalis maltase-glucoamylase, putative 0.0038 0.1092 0.5
Loa Loa (eye worm) intermediate filament protein 0.0027 0.0564 0.0564
Mycobacterium tuberculosis Possible cytochrome P450 135A1 Cyp135A1 0.0037 0.1024 0.5
Schistosoma mansoni cytochrome P450 0.0037 0.1024 0.0829
Trypanosoma cruzi cytochrome P450, putative 0.0072 0.2641 1

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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