Detailed information for compound 501070

Basic information

Technical information
  • TDR Targets ID: 501070
  • Name: 1-(3,5-dichlorophenyl)-4-(difluoromethyl)tria zole
  • MW: 264.059 | Formula: C9H5Cl2F2N3
  • H donors: 0 H acceptors: 2 LogP: 3.26 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: FC(c1nnn(c1)c1cc(Cl)cc(c1)Cl)F
  • InChi: 1S/C9H5Cl2F2N3/c10-5-1-6(11)3-7(2-5)16-4-8(9(12)13)14-15-16/h1-4,9H
  • InChiKey: YKXJXMLAUHDKPW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1-(3,5-dichlorophenyl)-4-(difluoromethyl)-1,2,3-triazole
  • 1H-1,2,3-Triazole, 1-(3,5-dichlorophenyl)-4-(difluoromethyl)-
  • AIDS-411639
  • AIDS411639

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
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0029 0.1667 0.1667
Chlamydia trachomatis pyruvate kinase 0.0034 0.2461 0.5
Loa Loa (eye worm) hypothetical protein 0.0029 0.1667 0.0844
Onchocerca volvulus Pyruvate kinase homolog 0.0034 0.2461 0.141
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.4338 0.5677
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0085 1 1
Plasmodium falciparum pyruvate kinase 0.0034 0.2461 1
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0029 0.1667 0.1667
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0029 0.1667 0.0844
Onchocerca volvulus 0.0066 0.7295 1
Schistosoma mansoni jun-related protein 0.0069 0.7641 1
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0038 0.3135 0.3135
Schistosoma mansoni hypothetical protein 0.0038 0.3135 0.4103
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.4338 0.5677
Loa Loa (eye worm) pyruvate kinase 0.0034 0.2461 0.1754
Loa Loa (eye worm) pyruvate kinase 0.0034 0.2461 0.1754
Schistosoma mansoni thyroid hormone receptor 0.0029 0.1667 0.2182
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0029 0.1667 0.1667
Schistosoma mansoni RAR-like nuclear receptor 0.0029 0.1667 0.2182
Schistosoma mansoni nuclear hormone receptor 0.0029 0.1667 0.2182
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0029 0.1667 0.0844
Entamoeba histolytica hypothetical protein 0.0038 0.3135 1
Entamoeba histolytica hypothetical protein 0.0038 0.3135 1
Brugia malayi Pyruvate kinase, M2 isozyme 0.0034 0.2461 0.0952
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.4338 0.4338
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.4338 0.3205
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0029 0.1667 0.0844
Loa Loa (eye worm) hypothetical protein 0.0029 0.1667 0.0844
Entamoeba histolytica hypothetical protein 0.0038 0.3135 1
Echinococcus granulosus pyruvate kinase 0.0034 0.2461 0.2461
Brugia malayi hypothetical protein 0.0066 0.7295 0.6754
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0085 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0029 0.1667 0.0844
Schistosoma mansoni hypothetical protein 0.0069 0.7641 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.4338 0.4338
Toxoplasma gondii pyruvate kinase PyK1 0.0034 0.2461 0.8195
Echinococcus granulosus inositol monophosphatase 1 0.0038 0.3003 0.3003
Schistosoma mansoni pyruvate kinase 0.0034 0.2461 0.3221
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.4338 0.4338
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0029 0.1667 0.1667
Echinococcus multilocularis pyruvate kinase 0.0034 0.2461 0.2461
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0029 0.1667 0.1667
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.3003 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.1667 0.0844
Echinococcus granulosus pyruvate kinase 0.0034 0.2461 0.2461
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0038 0.3003 0.5
Loa Loa (eye worm) hypothetical protein 0.0029 0.1667 0.0844
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.3003 1
Echinococcus granulosus jun protein 0.0085 1 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.2461 0.1754
Loa Loa (eye worm) hypothetical protein 0.0029 0.1667 0.0844
Echinococcus multilocularis pyruvate kinase 0.0027 0.1396 0.1396
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.4338 0.5677
Schistosoma mansoni transcription factor LCR-F1 0.0038 0.3135 0.4103
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0029 0.1667 0.1667
Schistosoma mansoni pyruvate kinase 0.0034 0.2461 0.3221
Mycobacterium leprae Probable pyruvate kinase PykA 0.0034 0.2461 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0029 0.1667 0.2182
Schistosoma mansoni steroid hormone receptor ad4bp 0.0029 0.1667 0.2182
Trichomonas vaginalis inositol monophosphatase, putative 0.0038 0.3003 1
Loa Loa (eye worm) steroid hormone receptor 0.0029 0.1667 0.0844
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0029 0.1667 0.1667
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0029 0.1667 0.2182
Schistosoma mansoni thyroid hormone receptor 0.0029 0.1667 0.2182
Echinococcus granulosus ecdysone induced protein 78C 0.0029 0.1667 0.1667
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0029 0.1667 0.1667
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.4338 0.3905
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0038 0.3135 0.3135
Schistosoma mansoni inositol monophosphatase 0.0038 0.3003 0.393
Echinococcus multilocularis ecdysone induced protein 78C 0.0029 0.1667 0.1667
Brugia malayi Inositol-1 0.0038 0.3003 0.1603
Loa Loa (eye worm) pyruvate kinase 0.0034 0.2461 0.1754
Echinococcus granulosus FTZ F1 alpha 0.0029 0.1667 0.1667
Schistosoma mansoni inositol monophosphatase 0.0038 0.3003 0.393
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0029 0.1667 0.1667
Brugia malayi hypothetical protein 0.0038 0.3135 0.1762
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.3003 1
Schistosoma mansoni coup transcription factor 0.0029 0.1667 0.2182
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.3003 1
Giardia lamblia Pyruvate kinase 0.0034 0.2461 1
Brugia malayi Pyruvate kinase, muscle isozyme 0.0034 0.2461 0.0952
Echinococcus multilocularis FTZ F1 alpha 0.0029 0.1667 0.1667
Echinococcus multilocularis thyroid hormone receptor alpha 0.0029 0.1667 0.1667
Echinococcus multilocularis pyruvate kinase 0.0034 0.2461 0.2461
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0029 0.1667 0.1667
Onchocerca volvulus Pyruvate kinase homolog 0.0034 0.2461 0.141
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0029 0.1667 0.1667
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0029 0.1667 0.1667
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0038 0.3003 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0029 0.1667 0.2182
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0029 0.1667 0.0844
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0038 0.3003 1
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0029 0.1667 0.1667
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0038 0.3003 1
Plasmodium vivax pyruvate kinase, putative 0.0034 0.2461 1
Echinococcus multilocularis jun protein 0.0085 1 1
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0038 0.3003 0.94
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0029 0.1667 0.0844
Loa Loa (eye worm) hypothetical protein 0.0029 0.1667 0.0844
Schistosoma mansoni retinoic acid receptor RXR 0.0029 0.1667 0.2182
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0029 0.1667 0.2182
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.0034 0.2461 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.1667 0.0844
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0029 0.1667 0.2182
Echinococcus multilocularis inositol monophosphatase 1 0.0038 0.3003 0.3003
Entamoeba histolytica hypothetical protein 0.0038 0.3135 1
Loa Loa (eye worm) inositol-1 0.0038 0.3003 0.2375
Loa Loa (eye worm) hypothetical protein 0.0082 0.9655 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.4338 0.4338
Onchocerca volvulus Pyruvate kinase homolog 0.0034 0.2461 0.141
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0029 0.1667 0.0844
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0038 0.3003 1
Loa Loa (eye worm) hypothetical protein 0.0029 0.1667 0.0844
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0029 0.1667 0.2182

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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