Detailed information for compound 673941

Basic information

Technical information
  • TDR Targets ID: 673941
  • Name: 3-(4-nitrophenyl)-5-(phenylsulfanylmethyl)-1, 2,4-oxadiazole
  • MW: 313.331 | Formula: C15H11N3O3S
  • H donors: 0 H acceptors: 4 LogP: 3.67 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: [O-][N+](=O)c1ccc(cc1)c1noc(n1)CSc1ccccc1
  • InChi: 1S/C15H11N3O3S/c19-18(20)12-8-6-11(7-9-12)15-16-14(21-17-15)10-22-13-4-2-1-3-5-13/h1-9H,10H2
  • InChiKey: SIOGMIGMTGKVRL-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • 3-(4-nitrophenyl)-5-[(phenylthio)methyl]-1,2,4-oxadiazole
  • ZINC00471306
  • STK321526

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
Giardia lamblia G2/mitotic-specific cyclin B 0.0159 0.1662 0.2481
Echinococcus multilocularis cyclin dependent kinase 0.0334 0.5463 1
Toxoplasma gondii cell-cycle-associated protein kinase CDK, putative 0.0334 0.5463 0.5
Leishmania major cell division related protein kinase 2,cdc2-related kinase 0.0334 0.5463 1
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0334 0.5463 0.4559
Trypanosoma cruzi cdc2-related kinase 1 0.0334 0.5463 1
Trichomonas vaginalis CMGC family protein kinase 0.0334 0.5463 1
Trichomonas vaginalis cyclin D, putative 0.0101 0.0408 0.0747
Echinococcus multilocularis cyclin dependent kinase 1 0.0334 0.5463 1
Loa Loa (eye worm) cyclin domain-containing protein 0.0543 1 1
Entamoeba histolytica cell division protein kinase 2, putative 0.0334 0.5463 1
Trypanosoma cruzi cdc2-related kinase 1 0.0334 0.5463 1
Trypanosoma brucei cdc2-related kinase 1 0.0334 0.5463 1
Plasmodium falciparum protein kinase 5 0.0334 0.5463 1
Echinococcus granulosus cyclin dependent kinase 5 0.0334 0.5463 1
Echinococcus granulosus cyclin dependent kinase 0.0334 0.5463 1
Entamoeba histolytica cell division protein kinase 2, putative 0.0334 0.5463 1
Trichomonas vaginalis cyclins, putative 0.0159 0.1662 0.3042
Echinococcus granulosus 5'partial|cyclin dependent kinase 1 0.0334 0.5463 1
Trichomonas vaginalis cyclin B, putative 0.0159 0.1662 0.3042
Trypanosoma cruzi cdc2-related kinase 3 0.0334 0.5463 1
Brugia malayi Cyclin, N-terminal domain containing protein 0.023 0.3218 0.1866
Echinococcus multilocularis G2:mitotic specific cyclin B3 0.023 0.3218 0.5558
Trichomonas vaginalis cyclins, putative 0.0159 0.1662 0.3042
Trichomonas vaginalis cyclins, putative 0.0101 0.0408 0.0747
Trichomonas vaginalis CMGC family protein kinase 0.0334 0.5463 1
Echinococcus granulosus G2:mitotic specific cyclin B3 0.023 0.3218 0.5558
Trypanosoma brucei cdc2-related kinase 3 0.0334 0.5463 1
Giardia lamblia Kinase, CMGC CDK 0.0334 0.5463 1
Giardia lamblia Kinase, CMGC CDK 0.0334 0.5463 1
Trichomonas vaginalis cyclin B, putative 0.0159 0.1662 0.3042
Trypanosoma cruzi cdc2-related kinase 3 0.0334 0.5463 1
Trichomonas vaginalis cyclin B3, putative 0.0101 0.0408 0.0747
Echinococcus granulosus cyclin dependent kinase 1 0.0334 0.5463 1
Onchocerca volvulus 0.0159 0.1662 0.5
Schistosoma mansoni cyclin B 0.0159 0.1662 0.2481
Trichomonas vaginalis cyclin B, putative 0.0159 0.1662 0.3042
Echinococcus multilocularis cyclin dependent kinase 1 0.0334 0.5463 1
Trichomonas vaginalis cyclin B, putative 0.0159 0.1662 0.3042
Leishmania major cell division protein kinase 2,cdc2-related kinase 0.0334 0.5463 1
Trichomonas vaginalis CMGC family protein kinase 0.0334 0.5463 1
Echinococcus granulosus cyclin B 0.0159 0.1662 0.2481
Schistosoma mansoni serine/threonine protein kinase 0.0334 0.5463 1
Trichomonas vaginalis cyclins, putative 0.0159 0.1662 0.3042
Brugia malayi Protein kinase domain containing protein 0.0334 0.5463 0.4559
Trichomonas vaginalis cyclin A, putative 0.0159 0.1662 0.3042
Loa Loa (eye worm) hypothetical protein 0.033 0.5386 0.4466
Loa Loa (eye worm) cyclin domain-containing protein 0.023 0.3218 0.1866
Schistosoma mansoni serine/threonine protein kinase 0.0334 0.5463 1
Echinococcus multilocularis cyclin dependent kinase 5 0.0334 0.5463 1
Trichomonas vaginalis cyclin B, putative 0.0101 0.0408 0.0747
Plasmodium vivax protein kinase Crk2 0.0334 0.5463 0.5
Loa Loa (eye worm) CMGC/CDK/CDK5 protein kinase 0.0334 0.5463 0.4559
Trichomonas vaginalis cyclins, putative 0.0159 0.1662 0.3042
Brugia malayi cell division control protein 2 homolog 0.0334 0.5463 0.4559
Entamoeba histolytica cyclin, putative 0.0159 0.1662 0.2481
Trichomonas vaginalis conserved hypothetical protein 0.0101 0.0408 0.0747
Trichomonas vaginalis cyclin D, putative 0.0101 0.0408 0.0747
Echinococcus multilocularis cyclin B 0.0159 0.1662 0.2481
Schistosoma mansoni cyclin B3 0.023 0.3218 0.5558
Loa Loa (eye worm) CMGC/CDK/CDC2 protein kinase 0.0334 0.5463 0.4559

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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