Detailed information for compound 1216524

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 560.87 | Formula: C30H48O6Si2
  • H donors: 0 H acceptors: 0 LogP: 9.58 Rotable bonds: 12
    Rule of 5 violations (Lipinski): 2
  • SMILES: COc1ccc(c(c1O[Si](C(C)(C)C)(C)C)O[Si](C(C)(C)C)(C)C)/C=C/c1cc(OC)c(c(c1)OC)OC
  • InChi: 1S/C30H48O6Si2/c1-29(2,3)37(11,12)35-26-22(16-15-21-19-24(32-8)27(34-10)25(20-21)33-9)17-18-23(31-7)28(26)36-38(13,14)30(4,5)6/h15-20H,1-14H3/b16-15+
  • InChiKey: RIQSNCUTZNZOQE-FOCLMDBBSA-N  


Substructure search Similarity search

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 granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0297 0.0297
Schistosoma mansoni jumonji/arid domain-containing protein 0.0064 0.0783 0.2785
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0297 0.1055
Schistosoma mansoni jumonji domain containing protein 0.0064 0.0783 0.2785
Brugia malayi latrophilin 2 splice variant baaae 0.0037 0.0003 0.0003
Loa Loa (eye worm) hypothetical protein 0.0134 0.2812 0.2812
Brugia malayi jmjC domain containing protein 0.0064 0.0783 0.0783
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0297 0.1055
Leishmania major choline/ethanolamine kinase, putative 0.0037 0 0.5
Loa Loa (eye worm) acetylcholinesterase 1 0.0134 0.2812 0.2812
Echinococcus multilocularis acetylcholinesterase 0.0134 0.2812 0.2812
Loa Loa (eye worm) jmjC domain-containing protein 0.0064 0.0783 0.0783
Loa Loa (eye worm) choline/ethanolamine kinase 0.0381 1 1
Entamoeba histolytica choline/ethanolamine kinase, putative 0.0037 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0054 0.05 0.05
Schistosoma mansoni hypothetical protein 0.0037 0.0003 0.0009
Plasmodium falciparum choline kinase 0.0381 1 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0054 0.05 0.05
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0297 0.0297
Echinococcus granulosus carboxylesterase 5A 0.0134 0.2812 0.2812
Brugia malayi Carboxylesterase family protein 0.0134 0.2812 0.2812
Loa Loa (eye worm) hypothetical protein 0.0037 0.0003 0.0003
Leishmania major choline kinase 0.0037 0 0.5
Trypanosoma cruzi choline ethanolamine kinase, putative 0.0037 0 0.5
Echinococcus granulosus lysine specific demethylase 5A 0.0064 0.0783 0.0783
Plasmodium vivax choline kinase, putative 0.0381 1 1
Echinococcus granulosus choline:ethanolamine kinase 0.0381 1 1
Toxoplasma gondii phosphotransferase enzyme family protein 0.0381 1 1
Loa Loa (eye worm) hypothetical protein 0.0134 0.2812 0.2812
Echinococcus multilocularis choline:ethanolamine kinase 0.0381 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0297 0.0297
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0047 0.0297 0.1055
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0134 0.2812 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0047 0.0297 0.0297
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0047 0.0297 0.0297
Schistosoma mansoni jumonji/arid domain-containing protein 0.0064 0.0783 0.2785
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0064 0.0783 0.0783
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0297 0.0297
Brugia malayi jmjC domain containing protein 0.0064 0.0783 0.0783
Trypanosoma brucei choline kinase 0.0037 0 0.5
Entamoeba histolytica choline/ethanolamine kinase, putative 0.0037 0 0.5
Onchocerca volvulus 0.0037 0 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0054 0.05 0.05
Echinococcus granulosus acetylcholinesterase 0.0134 0.2812 0.2812
Trypanosoma cruzi choline kinase 0.0037 0 0.5
Giardia lamblia Ethanolamine kinase, putative 0.0037 0 0.5
Brugia malayi Carboxylesterase family protein 0.0134 0.2812 0.2812
Echinococcus multilocularis acetylcholinesterase 0.0134 0.2812 0.2812
Echinococcus granulosus acetylcholinesterase 0.0134 0.2812 0.2812
Loa Loa (eye worm) carboxylesterase 0.0134 0.2812 0.2812
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0054 0.05 0.05
Trypanosoma brucei choline/ethanolamine kinase 0.0037 0 0.5
Onchocerca volvulus Putative choline\/ethanolamine kinase 0.0037 0 0.5
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0064 0.0783 0.0783
Trichomonas vaginalis choline/ethanolamine kinase, putative 0.0037 0 0.5
Echinococcus multilocularis carboxylesterase 5A 0.0134 0.2812 0.2812
Echinococcus multilocularis lysine specific demethylase 5A 0.0064 0.0783 0.0783

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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