Detailed information for compound 1092725

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 264.708 | Formula: C13H13ClN2O2
  • H donors: 0 H acceptors: 1 LogP: 2.78 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCOc1cnn(c(=O)c1Cl)c1cccc(c1)C
  • InChi: 1S/C13H13ClN2O2/c1-3-18-11-8-15-16(13(17)12(11)14)10-6-4-5-9(2)7-10/h4-8H,3H2,1-2H3
  • InChiKey: YMHQPVCIINSBRM-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
Loa Loa (eye worm) hypothetical protein 0.0031 0.4216 0.4216
Echinococcus multilocularis thyroid hormone receptor alpha 0.0031 0.4216 0.4798
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0051 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.8786 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0031 0.4216 0.4798
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0031 0.4216 0.4216
Onchocerca volvulus 0.0031 0.4216 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.8786 1
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0031 0.4216 0.4798
Brugia malayi nuclear hormone receptor 0.0031 0.4216 0.4216
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0031 0.4216 0.4798
Loa Loa (eye worm) hypothetical protein 0.0031 0.4216 0.4216
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.8786 1
Onchocerca volvulus Bile acid receptor homolog 0.0031 0.4216 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0031 0.4216 0.4216
Loa Loa (eye worm) hypothetical protein 0.0031 0.4216 0.4216
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0031 0.4216 0.4216
Echinococcus granulosus ecdysone induced protein 78C 0.0031 0.4216 0.4798
Loa Loa (eye worm) hypothetical protein 0.0031 0.4216 0.4216
Schistosoma mansoni thyroid hormone receptor 0.0031 0.4216 0.4798
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.8786 1
Brugia malayi ecdysteroid receptor 0.0031 0.4216 0.4216
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0031 0.4216 0.4216
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0031 0.4216 0.5
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0031 0.4216 0.4798
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0031 0.4216 0.4216
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0031 0.4216 0.4216
Brugia malayi Steroid receptor seven-up type 2 0.0031 0.4216 0.4216
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0031 0.4216 0.4216
Brugia malayi photoreceptor-specific nuclear receptor 0.0031 0.4216 0.4216
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0031 0.4216 0.4798
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.8786 0.8786
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0031 0.4216 0.4798
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0031 0.4216 0.4216
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.8786 1
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0031 0.4216 0.4798
Onchocerca volvulus Protein ultraspiracle homolog 0.0031 0.4216 0.5
Loa Loa (eye worm) hypothetical protein 0.0031 0.4216 0.4216
Loa Loa (eye worm) hypothetical protein 0.0031 0.4216 0.4216
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0031 0.4216 0.4798
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0031 0.4216 0.4216
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.8786 1
Loa Loa (eye worm) hypothetical protein 0.0051 1 1
Loa Loa (eye worm) hypothetical protein 0.0031 0.4216 0.4216
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0031 0.4216 0.4798
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0031 0.4216 0.4216
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0031 0.4216 0.4216
Schistosoma mansoni nuclear hormone receptor 0.0031 0.4216 0.4798
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.8786 1
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0031 0.4216 0.4798
Echinococcus multilocularis ecdysone induced protein 78C 0.0031 0.4216 0.4798
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0031 0.4216 0.4216
Loa Loa (eye worm) hypothetical protein 0.0035 0.5342 0.5342
Loa Loa (eye worm) steroid hormone receptor 0.0031 0.4216 0.4216
Schistosoma mansoni steroid hormone receptor ad4bp 0.0031 0.4216 0.4798
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0031 0.4216 0.4798
Brugia malayi nuclear receptor NHR-88 0.0031 0.4216 0.4216
Echinococcus multilocularis FTZ F1 alpha 0.0031 0.4216 0.4798
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0031 0.4216 0.4798
Schistosoma mansoni coup transcription factor 0.0031 0.4216 0.4798
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0031 0.4216 0.4798
Echinococcus granulosus FTZ F1 alpha 0.0031 0.4216 0.4798
Schistosoma mansoni hypothetical protein 0.0035 0.5342 0.608
Brugia malayi Nuclear hormone receptor-like 1 0.0031 0.4216 0.4216
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0031 0.4216 0.4798
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0031 0.4216 0.4216
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0031 0.4216 0.4216
Schistosoma mansoni retinoic acid receptor RXR 0.0031 0.4216 0.4798
Schistosoma mansoni RAR-like nuclear receptor 0.0031 0.4216 0.4798
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0031 0.4216 0.4216
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0031 0.4216 0.4216
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.8786 0.8786
Brugia malayi Calcitonin receptor-like protein seb-1 0.0051 1 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0031 0.4216 0.4216
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0031 0.4216 0.4216
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0031 0.4216 0.4798
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0031 0.4216 0.4798
Schistosoma mansoni thyroid hormone receptor 0.0031 0.4216 0.4798
Brugia malayi steroid hormone receptor 0.0031 0.4216 0.4216
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0031 0.4216 0.4216
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0031 0.4216 0.4798
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0031 0.4216 0.4798
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0031 0.4216 0.4216
Brugia malayi latrophilin 2 splice variant baaae 0.0035 0.5342 0.5342
Loa Loa (eye worm) hypothetical protein 0.0031 0.4216 0.4216
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0031 0.4216 0.4798

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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