Detailed information for compound 1568291

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 592.726 | Formula: C33H44N4O6
  • H donors: 0 H acceptors: 4 LogP: 5.01 Rotable bonds: 17
    Rule of 5 violations (Lipinski): 2
  • SMILES: CCOC(=O)N1CCN(CC1)CCCCCCCCN1C(=O)N(C(=O)C1(c1ccccc1)c1ccccc1)CC(=O)OC
  • InChi: 1S/C33H44N4O6/c1-3-43-32(41)35-24-22-34(23-25-35)20-14-6-4-5-7-15-21-37-31(40)36(26-29(38)42-2)30(39)33(37,27-16-10-8-11-17-27)28-18-12-9-13-19-28/h8-13,16-19H,3-7,14-15,20-26H2,1-2H3
  • InChiKey: FAHHXPUSFNOJNR-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 0.0092 0.1086 0.2553
Echinococcus granulosus protein jagged 2 0.0092 0.1086 0.0678
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Brugia malayi Cadherin domain containing protein 0.0092 0.1086 0.2808
Brugia malayi EGF-like domain containing protein 0.0092 0.1086 0.2808
Loa Loa (eye worm) animal heme peroxidase 0.0284 0.3868 1
Onchocerca volvulus Peroxidase homolog 0.0284 0.3868 1
Brugia malayi Animal haem peroxidase family protein 0.0284 0.3868 1
Schistosoma mansoni notch 0.0092 0.1086 0.0678
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Schistosoma mansoni hypothetical protein 0.0092 0.1086 0.0678
Echinococcus multilocularis neurogenic locus notch protein 0.0092 0.1086 0.0678
Schistosoma mansoni slit 0.0092 0.1086 0.0678
Brugia malayi Muscle positioning protein 4 0.0092 0.1086 0.2808
Echinococcus multilocularis protein jagged 1 0.0092 0.1086 0.0678
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Echinococcus multilocularis fibropellin Ia 0.0092 0.1086 0.0678
Schistosoma mansoni hypothetical protein 0.0092 0.1086 0.0678
Onchocerca volvulus Dual oxidase homolog 0.0284 0.3868 1
Schistosoma mansoni peroxidasin 0.0284 0.3868 0.3587
Onchocerca volvulus Peroxidase homolog 0.0284 0.3868 1
Onchocerca volvulus 0.0284 0.3868 1
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Echinococcus granulosus peroxidasin 0.0284 0.3868 0.3587
Schistosoma mansoni laminin gamma-3 chain 0.0092 0.1086 0.0678
Onchocerca volvulus 0.0284 0.3868 1
Echinococcus granulosus delta-like protein 1 0.0092 0.1086 0.0678
Schistosoma mansoni notch 0.0092 0.1086 0.0678
Brugia malayi GCC2 and GCC3 family protein 0.0092 0.1086 0.2808
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0133 0.5
Onchocerca volvulus Peroxidasin homolog 0.0284 0.3868 1
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Brugia malayi Transmembrane cell adhesion receptor mua-3 precursor, putative 0.0092 0.1086 0.2808
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Loa Loa (eye worm) animal heme peroxidase 0.0284 0.3868 1
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Brugia malayi Calcium binding EGF domain containing protein 0.0092 0.1086 0.2808
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Echinococcus multilocularis peroxidasin 0.0284 0.3868 0.3587
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Brugia malayi Peroxidasin 0.0284 0.3868 1
Echinococcus granulosus protein jagged 2 0.0092 0.1086 0.0678
Echinococcus multilocularis microtubule associated protein 2 0.0708 1 1
Echinococcus granulosus neurogenic locus notch protein 0.0092 0.1086 0.0678
Brugia malayi hypothetical protein 0.0026 0.0133 0.0343
Echinococcus granulosus neurogenic locus protein delta 0.0092 0.1086 0.0678
Schistosoma mansoni hypothetical protein 0.0092 0.1086 0.0678
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Schistosoma mansoni hypothetical protein 0.0092 0.1086 0.0678
Echinococcus granulosus protein jagged 1 0.0092 0.1086 0.0678
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Schistosoma mansoni cell polarity protein 0.0092 0.1086 0.0678
Giardia lamblia High cysteine protein 0.0092 0.1086 0.5
Onchocerca volvulus 0.0284 0.3868 1
Brugia malayi Animal haem peroxidase family protein 0.0284 0.3868 1
Echinococcus granulosus slit 2 protein 0.0092 0.1086 0.0678
Echinococcus multilocularis neurogenic locus protein delta 0.0092 0.1086 0.0678
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Echinococcus multilocularis slit 2 protein 0.0092 0.1086 0.0678
Schistosoma mansoni hypothetical protein 0.0092 0.1086 0.0678
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0133 0.5
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0047 0.0437 0.1131
Echinococcus granulosus fibropellin Ia 0.0092 0.1086 0.0678
Echinococcus granulosus neurogenic locus notch protein 0.0092 0.1086 0.0678
Brugia malayi Animal haem peroxidase family protein 0.0284 0.3868 1
Echinococcus granulosus neurogenic locus notch protein 4 0.0092 0.1086 0.0678
Brugia malayi Delta serrate ligand family protein 0.0092 0.1086 0.2808
Onchocerca volvulus Chorion peroxidase homolog 0.0284 0.3868 1
Schistosoma mansoni notch 0.0092 0.1086 0.0678
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Brugia malayi Animal haem peroxidase family protein 0.0284 0.3868 1
Loa Loa (eye worm) notch protein 0.0092 0.1086 0.2553
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0047 0.0437 0.0816
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Brugia malayi EGF-like domain containing protein 0.0092 0.1086 0.2808
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Brugia malayi EGF-like domain containing protein 0.0092 0.1086 0.2808
Echinococcus granulosus neural cadherin 0.0092 0.1086 0.0678
Schistosoma mansoni hypothetical protein 0.0174 0.2273 0.192
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Brugia malayi Animal haem peroxidase family protein 0.0284 0.3868 1
Loa Loa (eye worm) animal heme peroxidase 0.0284 0.3868 1
Schistosoma mansoni Pro-neuregulin-4 membrane-bound isoform (Pro-NRG4) [Contains: Neuregulin-4 (NRG-4)] 0.0092 0.1086 0.0678
Echinococcus multilocularis neurogenic locus protein delta 0.0092 0.1086 0.0678
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Loa Loa (eye worm) animal heme peroxidase 0.0284 0.3868 1
Schistosoma mansoni hypothetical protein 0.0092 0.1086 0.0678
Plasmodium falciparum ataxin-2 like protein, putative 0.0026 0.0133 0.5
Echinococcus multilocularis protein jagged 1 0.0092 0.1086 0.0678
Loa Loa (eye worm) Notch2 0.0092 0.1086 0.2553
Leishmania major hypothetical protein, conserved 0.0026 0.0133 0.5
Schistosoma mansoni septate junction protein 0.0092 0.1086 0.0678
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Schistosoma mansoni microtubule-associated protein tau 0.0708 1 1
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Loa Loa (eye worm) blistered cuticle protein 3 0.0284 0.3868 1
Echinococcus multilocularis protein jagged 2 0.0092 0.1086 0.0678
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Brugia malayi notch-like transmembrane receptor 0.0092 0.1086 0.2808
Brugia malayi Calcium binding EGF domain containing protein 0.0092 0.1086 0.2808
Brugia malayi EGF-like domain containing protein 0.0092 0.1086 0.2808
Onchocerca volvulus Peroxidasin homolog 0.0284 0.3868 1
Trypanosoma cruzi PAB1-binding protein , putative 0.0026 0.0133 0.5
Brugia malayi hypothetical protein 0.0284 0.3868 1
Schistosoma mansoni hypothetical protein 0.0092 0.1086 0.0678
Echinococcus multilocularis neurogenic locus notch protein 4 0.0092 0.1086 0.0678
Echinococcus multilocularis fat cadherin tumor suppressor 0.0092 0.1086 0.0678
Toxoplasma gondii EGF family domain-containing protein 0.0092 0.1086 1
Echinococcus granulosus protein jagged 1 0.0092 0.1086 0.0678
Plasmodium vivax ataxin-2 like protein, putative 0.0026 0.0133 0.5
Brugia malayi EGF-like domain containing protein 0.0092 0.1086 0.2808
Echinococcus multilocularis neurogenic locus notch protein 0.0092 0.1086 0.0678
Echinococcus granulosus notch 0.0092 0.1086 0.0678
Brugia malayi Cadherin domain containing protein 0.0092 0.1086 0.2808
Trypanosoma brucei PAB1-binding protein , putative 0.0026 0.0133 0.5
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Schistosoma mansoni peroxidasin 0.0284 0.3868 0.3587
Schistosoma mansoni notch 0.0092 0.1086 0.0678
Brugia malayi Blistered cuticle protein 3 0.0284 0.3868 1
Schistosoma mansoni notch 0.0092 0.1086 0.0678
Echinococcus granulosus geminin 0.0174 0.2273 0.192
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Loa Loa (eye worm) hypothetical protein 0.0284 0.3868 1
Schistosoma mansoni notch 0.0092 0.1086 0.0678
Brugia malayi EGF-like domain containing protein 0.0092 0.1086 0.2808
Echinococcus multilocularis notch 0.0092 0.1086 0.0678
Schistosoma mansoni hypothetical protein 0.0174 0.2273 0.192
Brugia malayi EGF-like domain containing protein 0.0092 0.1086 0.2808
Loa Loa (eye worm) hypothetical protein 0.0092 0.1086 0.2553
Brugia malayi Calcium binding EGF domain containing protein 0.0092 0.1086 0.2808
Echinococcus multilocularis neural cadherin 0.0092 0.1086 0.0678
Echinococcus multilocularis geminin 0.0174 0.2273 0.192

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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