Detailed information for compound 1472809

Basic information

Technical information
  • TDR Targets ID: 1472809
  • Name: 4-[2-[(2-chlorophenyl)methylamino]acetyl]-1,3 -dihydroquinoxalin-2-one
  • MW: 329.781 | Formula: C17H16ClN3O2
  • H donors: 2 H acceptors: 2 LogP: 1.99 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C1Nc2ccccc2N(C1)C(=O)CNCc1ccccc1Cl
  • InChi: 1S/C17H16ClN3O2/c18-13-6-2-1-5-12(13)9-19-10-17(23)21-11-16(22)20-14-7-3-4-8-15(14)21/h1-8,19H,9-11H2,(H,20,22)
  • InChiKey: ZKENWBYUMQUJJP-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-[2-[(2-chlorophenyl)methylamino]-1-oxoethyl]-1,3-dihydroquinoxalin-2-one
  • 4-[2-[(2-chlorobenzyl)amino]acetyl]-1,3-dihydroquinoxalin-2-one
  • 4-[2-[(2-chlorophenyl)methylamino]ethanoyl]-1,3-dihydroquinoxalin-2-one

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
Loa Loa (eye worm) inward rectifying k channel family protein 1 0.0173 1 1
Schistosoma mansoni retinoid-x-receptor (RXR) 0.001 0.0099 0.0442
Echinococcus granulosus ecdysone induced protein 78C 0.001 0.0099 0.0442
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.001 0.0099 0.0442
Trichomonas vaginalis ferritin, putative 0.0008 0 0.5
Echinococcus multilocularis FTZ F1 alpha 0.001 0.0099 0.0442
Toxoplasma gondii hypothetical protein 0.0173 1 0.5
Schistosoma mansoni steroid hormone receptor ad4bp 0.001 0.0099 0.0442
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.001 0.0099 0.5
Schistosoma mansoni thyroid hormone receptor 0.001 0.0099 0.0442
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0099 0.0442
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0099 0.0442
Onchocerca volvulus 0.001 0.0099 0.5
Schistosoma mansoni RAR-like nuclear receptor 0.001 0.0099 0.0442
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.2236 1
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.001 0.0099 0.0442
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.001 0.0099 0.0442
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.2236 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.001 0.0099 0.0442
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.001 0.0099 0.0442
Echinococcus multilocularis ecdysone induced protein 78C 0.001 0.0099 0.0442
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.001 0.0099 0.0442
Echinococcus granulosus nuclear receptor 2DBD gamma 0.001 0.0099 0.0442
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0045 0.2236 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.2236 1
Mycobacterium leprae PROBABLE BACTERIOFERRITIN BFRA 0.0008 0 0.5
Echinococcus granulosus retinoic acid receptor rxr beta a 0.001 0.0099 0.0442
Schistosoma mansoni thyroid hormone receptor 0.001 0.0099 0.0442
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.001 0.0099 0.0442
Loa Loa (eye worm) hypothetical protein 0.0173 1 1
Mycobacterium ulcerans bacterioferritin BfrB 0.0008 0 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.2236 1
Loa Loa (eye worm) hypothetical protein 0.0173 1 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0045 0.2236 1
Schistosoma mansoni retinoic acid receptor RXR 0.001 0.0099 0.0442
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0045 0.2236 1
Echinococcus granulosus FTZ F1 alpha 0.001 0.0099 0.0442
Schistosoma mansoni Tr4/Tr2 (homologue) 0.001 0.0099 0.0442
Mycobacterium tuberculosis Probable bacterioferritin BfrA 0.0008 0 0.5
Mycobacterium tuberculosis Bacterioferritin BfrB 0.0008 0 0.5
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.001 0.0099 0.0442
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.001 0.0099 0.0442
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0045 0.2236 0.2159
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.001 0.0099 0.0442
Echinococcus multilocularis thyroid hormone receptor alpha 0.001 0.0099 0.0442
Schistosoma mansoni coup transcription factor 0.001 0.0099 0.0442
Treponema pallidum bacterioferrin (TpF1) 0.0008 0 0.5
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.001 0.0099 0.0442
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0045 0.2236 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.001 0.0099 0.0442
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.001 0.0099 0.0442
Mycobacterium ulcerans bacterioferritin BfrA 0.0008 0 0.5
Onchocerca volvulus Protein ultraspiracle homolog 0.001 0.0099 0.5
Schistosoma mansoni nuclear hormone receptor 0.001 0.0099 0.0442
Onchocerca volvulus Bile acid receptor homolog 0.001 0.0099 0.5
Wolbachia endosymbiont of Brugia malayi bacterioferritin/cytochrome b1 0.0008 0 0.5

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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