Detailed information for compound 1808653

Basic information

Technical information
  • TDR Targets ID: 1808653
  • Name: 5-[(2-chlorophenoxy)methyl]-4-[[5-(2,4-dichlo rophenyl)furan-2-yl]methylideneamino]-2H-1,2, 4-triazole-3-thione
  • MW: 479.767 | Formula: C20H13Cl3N4O2S
  • H donors: 1 H acceptors: 0 LogP: 6.25 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(c(c1)Cl)c1ccc(o1)/C=N/n1c(COc2ccccc2Cl)n[nH]c1=S
  • InChi: 1S/C20H13Cl3N4O2S/c21-12-5-7-14(16(23)9-12)17-8-6-13(29-17)10-24-27-19(25-26-20(27)30)11-28-18-4-2-1-3-15(18)22/h1-10H,11H2,(H,26,30)/b24-10+
  • InChiKey: MKLQKMMVCZPKNH-YSURURNPSA-N  

Network

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Synonyms

  • 5-[(2-chlorophenoxy)methyl]-4-[[5-(2,4-dichlorophenyl)-2-furyl]methyleneamino]-2H-1,2,4-triazole-3-thione

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 hypothetical protein 0.0039 0.5569 1
Entamoeba histolytica hypothetical protein 0.0039 0.5569 0.5569
Mycobacterium leprae Probable NAD-dependent deacetylase NpdA (Regulatory protein SIR2 homolog) 0.0038 0.5318 0.5
Loa Loa (eye worm) transcriptional regulator 0.0018 0 0.5
Schistosoma mansoni transcription factor LCR-F1 0.0039 0.5569 0.5569
Echinococcus granulosus serine:threonine protein kinase Chk2 0.0034 0.4321 0.776
Plasmodium vivax NAD-dependent deacetylase, putative 0.0055 1 1
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.0055 1 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0039 0.5569 1
Leishmania major NAD dependent deacetylase, putative,transcriptional regulator, Sir2 family protein, nicotinic acid mononucleotide 5,6-dimethylbe 0.0055 1 1
Giardia lamblia Transcriptional regulator, Sir2 family 0.0055 1 1
Entamoeba histolytica hypothetical protein 0.0039 0.5569 0.5569
Trypanosoma brucei Silent information regulator 2 related protein 3 0.0055 1 1
Schistosoma mansoni serine/threonine protein kinase 0.0034 0.4321 0.4321
Echinococcus granulosus calcium:calmodulin dependent protein kinase I 0.0034 0.4318 0.7753
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0039 0.5569 1
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.0055 1 1
Loa Loa (eye worm) transcriptional regulator 0.0018 0 0.5
Trichomonas vaginalis chromatin regulatory protein sir2, putative 0.0055 1 1
Toxoplasma gondii histone deacetylase SIR2 0.0055 1 1
Entamoeba histolytica hypothetical protein 0.0039 0.5569 0.5569
Loa Loa (eye worm) transcriptional regulator 0.0018 0 0.5
Trypanosoma cruzi Silent information regulator 2 related protein 3 0.0055 1 1
Echinococcus multilocularis serine:threonine protein kinase Chk2 0.0034 0.4321 0.776
Entamoeba histolytica protein kinase, putative 0.0034 0.4321 0.4321
Schistosoma mansoni chromatin regulatory protein sir2 0.0055 1 1
Loa Loa (eye worm) hypothetical protein 0.0018 0 0.5
Loa Loa (eye worm) sirtuin 4 0.0018 0 0.5
Mycobacterium ulcerans NAD-dependent deacetylase 0.0055 1 1
Plasmodium falciparum transcriptional regulatory protein sir2a 0.0055 1 1
Schistosoma mansoni hypothetical protein 0.0039 0.5569 0.5569
Echinococcus multilocularis calcium:calmodulin dependent protein kinase I 0.0034 0.4318 0.7753
Entamoeba histolytica hypothetical protein 0.0039 0.5569 0.5569
Trypanosoma cruzi Silent information regulator 2 related protein 3 0.0055 1 1
Mycobacterium tuberculosis Transcriptional regulatory protein 0.0055 1 0.5
Entamoeba histolytica protein kinase, putative 0.0034 0.4321 0.4321

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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