Detailed information for compound 609363

Basic information

Technical information
  • TDR Targets ID: 609363
  • Name: N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]- 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]prop anamide
  • MW: 380.876 | Formula: C14H13ClN6OS2
  • H donors: 1 H acceptors: 5 LogP: 2.64 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(C(=O)Nc1nnc(s1)c1ccc(cc1)Cl)Sc1nncn1C
  • InChi: 1S/C14H13ClN6OS2/c1-8(23-14-20-16-7-21(14)2)11(22)17-13-19-18-12(24-13)9-3-5-10(15)6-4-9/h3-8H,1-2H3,(H,17,19,22)
  • InChiKey: ZKGLPGDNICVQFM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-1,2,4-triazol-3-yl)thio]propanamide
  • N-[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]-2-[(4-methyl-1,2,4-triazol-3-yl)thio]propionamide
  • Oprea1_652975

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) nuclear Hormone Receptor family member 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Brugia malayi nuclear hormone receptor family member nhr-6 0.0057 0.0984 0.2215
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0121 0.4446 1
Schistosoma mansoni thyroid hormone receptor 0.0121 0.4446 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0121 0.4446 1
Trichomonas vaginalis chromobox protein, putative 0.0042 0.016 0.0969
Onchocerca volvulus Protein ultraspiracle homolog 0.0121 0.4446 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0064 0.1355 0.1071
Echinococcus multilocularis ecdysone induced protein 78C 0.0121 0.4446 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0121 0.4446 1
Brugia malayi nuclear receptor NHR-88 0.0057 0.0984 0.2215
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0042 0.016 0.036
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0121 0.4446 1
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0121 0.4446 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0121 0.4446 1
Schistosoma mansoni retinoic acid receptor RXR 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0121 0.4446 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0121 0.4446 1
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0057 0.0984 0.2215
Brugia malayi steroid hormone receptor 0.0121 0.4446 1
Onchocerca volvulus 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Brugia malayi Steroid receptor seven-up type 2 0.0121 0.4446 1
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0121 0.4446 1
Brugia malayi Nuclear hormone receptor-like 1 0.0064 0.1355 0.3048
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0121 0.4446 1
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0121 0.4446 1
Brugia malayi nuclear hormone receptor 0.0057 0.0984 0.2215
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0064 0.1355 0.3048
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0121 0.4446 1
Brugia malayi hypothetical protein 0.0064 0.1355 0.3048
Loa Loa (eye worm) hypothetical protein 0.0121 0.4446 1
Trichomonas vaginalis chromobox protein, putative 0.0042 0.016 0.0969
Echinococcus multilocularis chromobox protein 1 0.007 0.1651 0.1926
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0057 0.0984 0.2215
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0064 0.1355 0.1071
Echinococcus multilocularis chromobox protein 1 0.007 0.1651 0.1926
Schistosoma mansoni RAR-like nuclear receptor 0.0121 0.4446 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0121 0.4446 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0121 0.4446 1
Trichomonas vaginalis chromobox protein, putative 0.007 0.1651 1
Brugia malayi Nuclear hormone receptor E75 0.0057 0.0984 0.2215
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0121 0.4446 1
Brugia malayi hypothetical protein 0.0057 0.0984 0.2215
Schistosoma mansoni thyroid hormone receptor 0.0121 0.4446 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0121 0.4446 1
Onchocerca volvulus 0.0057 0.0984 0.2215
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0121 0.4446 1
Brugia malayi nuclear receptor NHR-88 0.0121 0.4446 1
Brugia malayi hypothetical protein 0.0064 0.1355 0.3048
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0121 0.4446 1
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0121 0.4446 1
Brugia malayi Nuclear hormone receptor-like 1 0.0121 0.4446 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0121 0.4446 1
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0121 0.4446 1
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0064 0.1355 0.1071
Loa Loa (eye worm) nuclear hormone receptor 0.0057 0.0984 0.2215
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0121 0.4446 1
Brugia malayi nuclear hormone receptor 0.0121 0.4446 1
Onchocerca volvulus Bile acid receptor homolog 0.0121 0.4446 1
Onchocerca volvulus 0.0057 0.0984 0.2215
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0121 0.4446 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0121 0.4446 1
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0121 0.4446 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Loa Loa (eye worm) hypothetical protein 0.0121 0.4446 1
Loa Loa (eye worm) nuclear receptor NHR-67 0.0057 0.0984 0.2215
Brugia malayi nuclear receptor RXR 0.0057 0.0984 0.2215
Brugia malayi Nuclear hormone receptor-like 1 0.0064 0.1355 0.3048
Echinococcus granulosus chromobox protein 1 0.007 0.1651 0.1926
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0121 0.4446 1
Trichomonas vaginalis chromobox protein, putative 0.007 0.1651 1
Schistosoma mansoni nuclear hormone receptor 0.0121 0.4446 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0121 0.4446 1
Echinococcus granulosus chromobox protein 1 0.007 0.1651 0.1926
Brugia malayi ecdysteroid receptor 0.0121 0.4446 1
Brugia malayi Nuclear hormone receptor E75 0.0057 0.0984 0.2215
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0057 0.0984 0.2215
Loa Loa (eye worm) steroid hormone receptor 0.0121 0.4446 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0121 0.4446 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Brugia malayi tailless protein 0.0057 0.0984 0.2215
Loa Loa (eye worm) DR-78 0.0057 0.0984 0.2215
Loa Loa (eye worm) hypothetical protein 0.0121 0.4446 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0121 0.4446 1
Loa Loa (eye worm) heterochromatin protein 1 0.007 0.1651 0.3714
Brugia malayi photoreceptor-specific nuclear receptor 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0121 0.4446 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0121 0.4446 1
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0057 0.0984 0.2215
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0121 0.4446 1
Brugia malayi conserved hypotetical protein 0.0057 0.0984 0.2215
Echinococcus multilocularis FTZ F1 alpha 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0064 0.1355 0.3048
Loa Loa (eye worm) hypothetical protein 0.0064 0.1355 0.3048
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Schistosoma mansoni chromobox protein 0.007 0.1651 0.1926
Echinococcus granulosus FTZ F1 alpha 0.0121 0.4446 1
Brugia malayi nuclear receptor RXR 0.0064 0.1355 0.3048
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Schistosoma mansoni chromobox protein 0.007 0.1651 0.1926
Loa Loa (eye worm) hypothetical protein 0.0064 0.1355 0.3048
Echinococcus granulosus ecdysone induced protein 78C 0.0121 0.4446 1
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0121 0.4446 1
Brugia malayi Heterochromatin protein 1 0.007 0.1651 0.3714
Schistosoma mansoni steroid hormone receptor ad4bp 0.0121 0.4446 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0121 0.4446 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0121 0.4446 1
Loa Loa (eye worm) hypothetical protein 0.0064 0.1355 0.3048
Brugia malayi ecdysone receptor 0.0057 0.0984 0.2215
Loa Loa (eye worm) hypothetical protein 0.0064 0.1355 0.3048
Loa Loa (eye worm) hypothetical protein 0.0057 0.0984 0.2215
Brugia malayi nuclear receptor NHR-67 0.0057 0.0984 0.2215
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0064 0.1355 0.1071
Schistosoma mansoni coup transcription factor 0.0121 0.4446 1
Brugia malayi hypothetical protein 0.0057 0.0984 0.2215
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0121 0.4446 1
Brugia malayi orphan nuclear receptor NR2E1 0.0057 0.0984 0.2215
Brugia malayi nuclear hormone receptor family member odr-7 0.0057 0.0984 0.2215

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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