Detailed information for compound 1750833

Basic information

Technical information
  • TDR Targets ID: 1750833
  • Name: 6-(4-methoxyphenyl)-3-(5-methyl-1H-pyrazol-3- yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
  • MW: 312.35 | Formula: C14H12N6OS
  • H donors: 1 H acceptors: 4 LogP: 2.28 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)c1nn2c(s1)nnc2c1[nH]nc(c1)C
  • InChi: 1S/C14H12N6OS/c1-8-7-11(16-15-8)12-17-18-14-20(12)19-13(22-14)9-3-5-10(21-2)6-4-9/h3-7H,1-2H3,(H,15,16)
  • InChiKey: HMFUVOVOMRPEDP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • ST5423621
  • ZINC05457339
  • NCGC00164755-01

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 nuclear hormone receptor 0.0149 1 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0149 1 1
Brugia malayi ecdysone receptor 0.007 0.3601 0.3601
Brugia malayi photoreceptor-specific nuclear receptor 0.0149 1 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0149 1 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0149 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0149 1 1
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0149 1 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0149 1 1
Loa Loa (eye worm) nuclear hormone receptor 0.007 0.3601 0.3601
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0149 1 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0149 1 1
Brugia malayi Nuclear hormone receptor-like 1 0.0079 0.4286 0.4286
Loa Loa (eye worm) hypothetical protein 0.0149 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0149 1 1
Schistosoma mansoni coup transcription factor 0.0149 1 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0149 1 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0149 1 1
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.007 0.3601 0.3601
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Echinococcus granulosus FTZ F1 alpha 0.0149 1 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0149 1 1
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Brugia malayi orphan nuclear receptor NR2E1 0.007 0.3601 0.3601
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Brugia malayi Nuclear hormone receptor E75 0.007 0.3601 0.3601
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0149 1 1
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0149 1 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.4286 0.4286
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Schistosoma mansoni thyroid hormone receptor 0.0149 1 1
Loa Loa (eye worm) steroid hormone receptor 0.0149 1 1
Brugia malayi Nuclear hormone receptor-like 1 0.0149 1 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0149 1 1
Brugia malayi Nuclear hormone receptor E75 0.007 0.3601 0.3601
Brugia malayi hypothetical protein 0.007 0.3601 0.3601
Loa Loa (eye worm) hypothetical protein 0.0079 0.4286 0.4286
Loa Loa (eye worm) hypothetical protein 0.0149 1 1
Brugia malayi Steroid receptor seven-up type 2 0.0149 1 1
Brugia malayi hypothetical protein 0.0079 0.4286 0.4286
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0149 1 1
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Brugia malayi tailless protein 0.007 0.3601 0.3601
Loa Loa (eye worm) hypothetical protein 0.0149 1 1
Onchocerca volvulus Protein ultraspiracle homolog 0.0149 1 1
Echinococcus granulosus ecdysone induced protein 78C 0.0149 1 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.4286 0.4286
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0149 1 1
Loa Loa (eye worm) DR-78 0.007 0.3601 0.3601
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0149 1 1
Loa Loa (eye worm) hypothetical protein 0.0149 1 1
Brugia malayi nuclear hormone receptor family member odr-7 0.007 0.3601 0.3601
Brugia malayi Nuclear hormone receptor-like 1 0.0079 0.4286 0.4286
Brugia malayi nuclear receptor NHR-88 0.007 0.3601 0.3601
Loa Loa (eye worm) hypothetical protein 0.0149 1 1
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Loa Loa (eye worm) hypothetical protein 0.0079 0.4286 0.4286
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Loa Loa (eye worm) hypothetical protein 0.0149 1 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0149 1 1
Brugia malayi nuclear receptor RXR 0.0079 0.4286 0.4286
Brugia malayi nuclear receptor NHR-88 0.0149 1 1
Leishmania major cytochrome p450-like protein 0.0026 0 0.5
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0149 1 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0149 1 1
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0149 1 1
Schistosoma mansoni thyroid hormone receptor 0.0149 1 1
Mycobacterium ulcerans cytochrome P450 185A4 Cyp185A4 0.0026 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0149 1 1
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0149 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0149 1 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0149 1 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0149 1 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0149 1 1
Schistosoma mansoni retinoic acid receptor RXR 0.0149 1 1
Loa Loa (eye worm) nuclear receptor nhr-7B 0.007 0.3601 0.3601
Echinococcus multilocularis thyroid hormone receptor alpha 0.0149 1 1
Brugia malayi nuclear hormone receptor 0.0149 1 1
Schistosoma mansoni steroid hormone receptor ad4bp 0.0149 1 1
Brugia malayi hypothetical protein 0.007 0.3601 0.3601
Trypanosoma cruzi cytochrome P450, putative 0.0026 0 0.5
Brugia malayi conserved hypotetical protein 0.007 0.3601 0.3601
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0149 1 1
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0079 0.4286 0.4286
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0149 1 1
Schistosoma mansoni RAR-like nuclear receptor 0.0149 1 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0149 1 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0079 0.4286 0.1071
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0149 1 1
Brugia malayi nuclear hormone receptor family member nhr-6 0.007 0.3601 0.3601
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0149 1 1
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0149 1 1
Loa Loa (eye worm) hypothetical protein 0.007 0.3601 0.3601
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0149 1 1
Trypanosoma brucei cytochrome P450, putative 0.0026 0 0.5
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0149 1 1
Onchocerca volvulus 0.0149 1 1
Brugia malayi nuclear receptor RXR 0.007 0.3601 0.3601
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0149 1 1
Trypanosoma cruzi cytochrome P450, putative 0.0026 0 0.5
Onchocerca volvulus Bile acid receptor homolog 0.0149 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0149 1 1
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0149 1 1
Loa Loa (eye worm) hypothetical protein 0.0079 0.4286 0.4286
Brugia malayi nuclear hormone receptor 0.007 0.3601 0.3601
Loa Loa (eye worm) hypothetical protein 0.0149 1 1
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0079 0.4286 0.1071
Echinococcus multilocularis ecdysone induced protein 78C 0.0149 1 1
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0149 1 1
Echinococcus multilocularis FTZ F1 alpha 0.0149 1 1
Brugia malayi hypothetical protein 0.0079 0.4286 0.4286
Loa Loa (eye worm) nuclear receptor NHR-67 0.007 0.3601 0.3601
Brugia malayi nuclear receptor NHR-67 0.007 0.3601 0.3601
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0149 1 1
Brugia malayi steroid hormone receptor 0.0149 1 1
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0079 0.4286 0.1071
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0079 0.4286 0.1071

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.