Detailed information for compound 672340

Basic information

Technical information
  • TDR Targets ID: 672340
  • Name: 2-[[5-(2,4-dichlorophenyl)-4-ethyl-1,2,4-tria zol-3-yl]sulfanyl]-N-(2-methoxyphenyl)acetami de
  • MW: 437.343 | Formula: C19H18Cl2N4O2S
  • H donors: 1 H acceptors: 3 LogP: 4.36 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccccc1NC(=O)CSc1nnc(n1CC)c1ccc(cc1Cl)Cl
  • InChi: 1S/C19H18Cl2N4O2S/c1-3-25-18(13-9-8-12(20)10-14(13)21)23-24-19(25)28-11-17(26)22-15-6-4-5-7-16(15)27-2/h4-10H,3,11H2,1-2H3,(H,22,26)
  • InChiKey: PMHIBVADMQCALR-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[[5-(2,4-dichlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(2-methoxyphenyl)acetamide
  • 2-[[5-(2,4-dichlorophenyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxyphenyl)ethanamide
  • STK120015

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
Brugia malayi Melibiase family protein 0.0069 0.19 0.2187
Echinococcus granulosus lysine specific demethylase 5A 0.0036 0.0314 0.0887
Echinococcus granulosus jumonji domain containing protein 0.0041 0.0568 0.1604
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0103 0.354 1
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.021 0.8618 1
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0061 0.1536 0.5
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0061 0.1536 0.4339
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0069 0.19 0.5343
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0103 0.354 1
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0069 0.19 0.5343
Trichomonas vaginalis set domain proteins, putative 0.0239 1 1
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0061 0.1536 0.4308
Brugia malayi jmjC domain containing protein 0.0096 0.3206 0.3706
Echinococcus granulosus peregrin 0.0029 0.0019 0.0054
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.1536 0.5
Loa Loa (eye worm) jmjC domain-containing protein 0.0061 0.1511 0.1735
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.1536 0.5
Loa Loa (eye worm) jmjC domain-containing protein 0.0036 0.0314 0.0343
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0053 0.0095
Brugia malayi Pre-SET motif family protein 0.003 0.0053 0.0039
Plasmodium vivax SET domain protein, putative 0.003 0.0053 1
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.354 1
Schistosoma mansoni jumonji domain containing protein 0.0077 0.2263 0.6374
Brugia malayi Pre-SET motif family protein 0.021 0.8618 1
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0053 0.0149
Giardia lamblia PHD finger protein 15 0.0029 0.0019 0.5
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.354 1
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0061 0.1536 0.5
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0053 0.0095
Toxoplasma gondii aldehyde dehydrogenase 0.0061 0.1536 0.4308
Toxoplasma gondii melibiase subfamily protein 0.0103 0.354 1
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0096 0.3206 0.9058
Loa Loa (eye worm) hypothetical protein 0.0069 0.19 0.2187
Plasmodium falciparum phd finger protein, putative 0.0029 0.0019 0.5
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0053 0.0095
Echinococcus multilocularis lysine specific demethylase 5A 0.0036 0.0314 0.0837
Loa Loa (eye worm) hypothetical protein 0.005 0.102 0.1164
Echinococcus granulosus PHD finger protein rhinoceros 0.0029 0.0019 0.0054
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0103 0.354 1
Brugia malayi jmjC domain containing protein 0.0036 0.0314 0.0343
Loa Loa (eye worm) hypothetical protein 0.003 0.0053 0.0039
Schistosoma mansoni jumonji/arid domain-containing protein 0.0036 0.0314 0.0837
Echinococcus multilocularis jumonji domain containing protein 0.0041 0.0568 0.1558
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.354 1
Schistosoma mansoni jumonji/arid domain-containing protein 0.0036 0.0314 0.0837
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0053 0.0095
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0053 0.0095
Schistosoma mansoni aldehyde dehydrogenase 0.0061 0.1536 0.4308
Onchocerca volvulus 0.003 0.0053 0.0034
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.354 1
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0053 0.0095
Schistosoma mansoni aldehyde dehydrogenase 0.0061 0.1536 0.4308
Mycobacterium ulcerans aldehyde dehydrogenase 0.0061 0.1536 0.5
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0096 0.3206 0.9053
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0053 0.0095

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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