Detailed information for compound 649597

Basic information

Technical information
  • TDR Targets ID: 649597
  • Name: (5Z)-3-[(2-chlorophenyl)methyl]-5-[(4-methylp henyl)methylidene]-1,3-thiazolidine-2,4-dione
  • MW: 343.827 | Formula: C18H14ClNO2S
  • H donors: 0 H acceptors: 2 LogP: 4.86 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)C=C1SC(=O)N(C1=O)Cc1ccccc1Cl
  • InChi: 1S/C18H14ClNO2S/c1-12-6-8-13(9-7-12)10-16-17(21)20(18(22)23-16)11-14-4-2-3-5-15(14)19/h2-10H,11H2,1H3/b16-10-
  • InChiKey: DYRQSDADVQLEAX-YBEGLDIGSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 3-[(2-chlorophenyl)methyl]-5-[(4-methylphenyl)methylidene]-1,3-thiazolidine-2,4-dione
  • (5Z)-3-[(2-chlorophenyl)methyl]-5-[(4-methylphenyl)methylene]thiazolidine-2,4-dione
  • 3-[(2-chlorophenyl)methyl]-5-[(4-methylphenyl)methylene]thiazolidine-2,4-dione
  • (5Z)-3-(2-chlorobenzyl)-5-(4-methylbenzylidene)thiazolidine-2,4-quinone
  • 3-(2-chlorobenzyl)-5-(4-methylbenzylidene)thiazolidine-2,4-quinone
  • ZINC01180956

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
Echinococcus multilocularis lysosomal alpha glucosidase 0.0164 0.095 0.951
Leishmania major mitochondrial DNA polymerase beta 0.0304 0.1993 1
Trichomonas vaginalis glutaminase, putative 0.0275 0.1778 1
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0304 0.1993 1
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0144 0.08 0.4016
Entamoeba histolytica fatty acid elongase, putative 0.0179 0.1063 1
Mycobacterium ulcerans 3-oxoacyl-ACP synthase 0.1379 1 1
Schistosoma mansoni hypothetical protein 0.0171 0.0999 0.5619
Plasmodium vivax beta-ketoacyl-acyl carrier protein synthase III precursor, putative 0.1379 1 0.5
Wolbachia endosymbiont of Brugia malayi 3-oxoacyl-ACP synthase 0.1379 1 0.5
Schistosoma mansoni glutaminase 0.0275 0.1778 1
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0304 0.1993 1
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0047 0.0237
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0052 0.0117 0.0587
Schistosoma mansoni hypothetical protein 0.0171 0.0999 0.5619
Onchocerca volvulus 0.0095 0.0435 0.5
Echinococcus granulosus geminin 0.0171 0.0999 1
Entamoeba histolytica fatty acid elongase, putative 0.0179 0.1063 1
Mycobacterium tuberculosis 3-oxoacyl-[acyl-carrier-protein] synthase III FabH (beta-ketoacyl-ACP synthase III) (KAS III) 0.1379 1 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0164 0.095 0.5344
Mycobacterium ulcerans beta-ketoacyl synthase-like protein 0.1379 1 1
Loa Loa (eye worm) glutaminase 0.0275 0.1778 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0144 0.08 0.4016
Brugia malayi glutaminase DH11.1 0.0275 0.1778 1
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0304 0.1993 1
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0164 0.095 0.5344
Echinococcus multilocularis lysosomal alpha glucosidase 0.0164 0.095 0.951
Mycobacterium ulcerans glutaminase 0.0275 0.1778 0.0943
Echinococcus granulosus lysosomal alpha glucosidase 0.0164 0.095 0.951
Echinococcus multilocularis geminin 0.0171 0.0999 1
Entamoeba histolytica fatty acid elongase, putative 0.0179 0.1063 1
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0043 0.0047 0.0237
Plasmodium falciparum beta-ketoacyl-ACP synthase III 0.1379 1 0.5
Entamoeba histolytica fatty acid elongase, putative 0.0179 0.1063 1
Entamoeba histolytica fatty acid elongase, putative 0.0179 0.1063 1
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0043 0.0047 0.0237
Schistosoma mansoni alpha-glucosidase 0.0141 0.078 0.4388
Mycobacterium ulcerans 3-oxoacyl-ACP synthase 0.1379 1 1
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0043 0.0047 0.0237
Toxoplasma gondii hypothetical protein 0.0049 0.0094 1
Loa Loa (eye worm) glutaminase 2 0.0275 0.1778 1
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0144 0.08 0.4016
Schistosoma mansoni alpha-glucosidase 0.0141 0.078 0.4388

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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