Detailed information for compound 837059

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 410.893 | Formula: C23H23ClN2O3
  • H donors: 1 H acceptors: 2 LogP: 5.48 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCc1ccc(cc1)NC(=O)c1cccn(c1=O)OCc1cccc(c1)Cl
  • InChi: 1S/C23H23ClN2O3/c1-2-3-6-17-10-12-20(13-11-17)25-22(27)21-9-5-14-26(23(21)28)29-16-18-7-4-8-19(24)15-18/h4-5,7-15H,2-3,6,16H2,1H3,(H,25,27)
  • InChiKey: FIUIVWFOGHOTQT-UHFFFAOYSA-N  

Network

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Synonyms

No synonyms found for this compound

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 serine:threonine protein kinase PLK1 0.0098 0.2561 0.4728
Echinococcus granulosus geminin 0.0176 0.5017 1
Onchocerca volvulus 0.0157 0.4416 1
Echinococcus multilocularis geminin 0.0176 0.5017 1
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.2561 1
Schistosoma mansoni hypothetical protein 0.0176 0.5017 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0645 0.0617
Loa Loa (eye worm) tumor suppressor 0.0334 1 1
Schistosoma mansoni serine/threonine protein kinase 0.0098 0.2561 0.4728
Schistosoma mansoni hypothetical protein 0.0037 0.0645 0.0617
Brugia malayi Muscleblind-like protein 0.0155 0.436 0.436
Echinococcus multilocularis muscleblind protein 1 0.0155 0.436 0.8589
Loa Loa (eye worm) hypothetical protein 0.0155 0.436 0.419
Echinococcus multilocularis muscleblind protein 0.0155 0.436 0.8589
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.2561 1
Schistosoma mansoni hypothetical protein 0.0176 0.5017 1
Schistosoma mansoni kinase 0.005 0.1039 0.1462
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0645 0.0617
Trypanosoma cruzi polo-like protein kinase, putative 0.0098 0.2561 1
Brugia malayi hypothetical protein 0.0028 0.0358 0.0358
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0293 0.5
Brugia malayi serine/threonine-protein kinase plk-2 0.0098 0.2561 0.2561
Brugia malayi hypothetical protein 0.0157 0.4416 0.4416
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0645 0.0617
Entamoeba histolytica serine/threonine protein kinase, putative 0.0098 0.2561 1
Loa Loa (eye worm) hypothetical protein 0.0155 0.436 0.419
Echinococcus granulosus serine:threonine protein kinase PLK1 0.0098 0.2561 0.4728
Toxoplasma gondii LsmAD domain-containing protein 0.0026 0.0293 0.5
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0293 0.5
Loa Loa (eye worm) PLK/PLK1 protein kinase 0.0098 0.2561 0.2337
Giardia lamblia Kinase, PLK 0.0098 0.2561 0.5
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.2561 1
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0293 0.5
Trypanosoma brucei polo-like protein kinase 0.0098 0.2561 1
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.2561 1
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.2561 1
Echinococcus granulosus muscleblind protein 0.0155 0.436 0.8589
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.2561 1
Brugia malayi hypothetical protein 0.0037 0.0645 0.0645
Loa Loa (eye worm) hypothetical protein 0.0028 0.0358 0.0068
Trichomonas vaginalis CAMK family protein kinase 0.0098 0.2561 1
Trypanosoma cruzi polo-like protein kinase, putative 0.0098 0.2561 1
Leishmania major protein kinase, putative,polo-like protein kinase, putative 0.0098 0.2561 1
Brugia malayi hypothetical protein 0.0026 0.0293 0.0293
Loa Loa (eye worm) hypothetical protein 0.0157 0.4416 0.4248
Brugia malayi Temporarily assigned gene name protein 44 0.0028 0.0358 0.0358

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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