Detailed information for compound 884002

Basic information

Technical information
  • TDR Targets ID: 884002
  • Name: 5,7-dimethyl-2-methylsulfanyl-[1,3,4]thiadiaz olo[3,2-a]pyrimidin-4-ium
  • MW: 212.315 | Formula: C8H10N3S2+
  • H donors: 0 H acceptors: 2 LogP: 2.81 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: CSc1n[n+]2c(s1)nc(cc2C)C
  • InChi: 1S/C8H10N3S2/c1-5-4-6(2)11-7(9-5)13-8(10-11)12-3/h4H,1-3H3/q+1
  • InChiKey: OONAAUHNKQLADE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 5,7-dimethyl-2-(methylthio)-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium
  • ZINC00078038

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
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.0199 0.3678 0.5
Loa Loa (eye worm) hypothetical protein 0.0011 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0011 0 0.5
Mycobacterium leprae PROBABLE POLYPEPTIDE DEFORMYLASE DEF (PDF) (FORMYLMETHIONINE DEFORMYLASE) 0.0521 1 0.5
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0 0.5
Mycobacterium tuberculosis Probable polypeptide deformylase Def (PDF) (formylmethionine deformylase) 0.0521 1 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.0011 0 0.5
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0011 0 0.5
Mycobacterium ulcerans peptide deformylase 0.0521 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0011 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0011 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0011 0 0.5
Plasmodium vivax peptide deformylase, putative 0.0521 1 0.5
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0011 0 0.5
Brugia malayi nuclear receptor NHR-88 0.0011 0 0.5
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0011 0 0.5
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0011 0 0.5
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0011 0 0.5
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0011 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0 0.5
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0011 0 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0011 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0011 0 0.5
Echinococcus multilocularis FTZ F1 alpha 0.0011 0 0.5
Wolbachia endosymbiont of Brugia malayi peptide deformylase 0.0521 1 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0011 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0011 0 0.5
Trypanosoma cruzi Peptide deformylase 2, putative 0.0199 0.3678 0.5
Treponema pallidum polypeptide deformylase (def) 0.0521 1 0.5
Brugia malayi Steroid receptor seven-up type 2 0.0011 0 0.5
Schistosoma mansoni thyroid hormone receptor 0.0011 0 0.5
Trypanosoma brucei Polypeptide deformylase 1 0.0199 0.3678 0.5
Loa Loa (eye worm) hypothetical protein 0.0011 0 0.5
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0 0.5
Trypanosoma cruzi Peptide deformylase 2, putative 0.0199 0.3678 0.5
Schistosoma mansoni thyroid hormone receptor 0.0011 0 0.5
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0011 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0011 0 0.5
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0011 0 0.5
Schistosoma mansoni retinoic acid receptor RXR 0.0011 0 0.5
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0011 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0011 0 0.5
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0011 0 0.5
Echinococcus multilocularis thyroid hormone receptor alpha 0.0011 0 0.5
Echinococcus granulosus FTZ F1 alpha 0.0011 0 0.5
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0011 0 0.5
Trypanosoma brucei Peptide deformylase 2 0.0199 0.3678 0.5
Schistosoma mansoni nuclear hormone receptor 0.0011 0 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0011 0 0.5
Onchocerca volvulus Protein ultraspiracle homolog 0.0011 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0011 0 0.5
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.0199 0.3678 0.5
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0011 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0011 0 0.5
Leishmania major polypeptide deformylase-like protein, putative 0.0199 0.3678 0.5
Schistosoma mansoni RAR-like nuclear receptor 0.0011 0 0.5
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0011 0 0.5
Schistosoma mansoni steroid hormone receptor ad4bp 0.0011 0 0.5
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0011 0 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0011 0 0.5
Echinococcus granulosus ecdysone induced protein 78C 0.0011 0 0.5
Loa Loa (eye worm) steroid hormone receptor 0.0011 0 0.5
Brugia malayi ecdysteroid receptor 0.0011 0 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0 0.5
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0011 0 0.5
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0011 0 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0011 0 0.5
Schistosoma mansoni coup transcription factor 0.0011 0 0.5
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0011 0 0.5
Plasmodium falciparum peptide deformylase 0.0521 1 0.5
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0011 0 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0011 0 0.5
Onchocerca volvulus Bile acid receptor homolog 0.0011 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0011 0 0.5
Brugia malayi steroid hormone receptor 0.0011 0 0.5
Brugia malayi nuclear hormone receptor 0.0011 0 0.5
Onchocerca volvulus 0.0011 0 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0011 0 0.5
Echinococcus multilocularis ecdysone induced protein 78C 0.0011 0 0.5
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0011 0 0.5
Toxoplasma gondii hypothetical protein 0.0521 1 0.5
Loa Loa (eye worm) hypothetical protein 0.0011 0 0.5
Brugia malayi photoreceptor-specific nuclear receptor 0.0011 0 0.5
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0011 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0011 0 0.5

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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