Detailed information for compound 1857690

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 401.973 | Formula: C23H32ClN3O
  • H donors: 1 H acceptors: 1 LogP: 4.38 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1cccc(c1)N1CCN(CC1)CCCNC(=O)C12CC3CC2CC(C1)C3
  • InChi: 1S/C23H32ClN3O/c24-20-3-1-4-21(14-20)27-9-7-26(8-10-27)6-2-5-25-22(28)23-15-17-11-18(16-23)13-19(23)12-17/h1,3-4,14,17-19H,2,5-13,15-16H2,(H,25,28)
  • InChiKey: LTNBBDRKQZBSKL-UHFFFAOYSA-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
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0002 0 0.5
Brugia malayi neuropeptide F receptor 0.0009 0.0236 0.5
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0002 0 0.5
Brugia malayi Dopamine receptor protein 1 0.0009 0.0236 0.5
Onchocerca volvulus Dopamine\/Ecdysteroid receptor homolog 0.0009 0.0236 0.5
Echinococcus multilocularis serotonin receptor 0.0156 0.5724 0.5621
Onchocerca volvulus 0.0009 0.0236 0.5
Brugia malayi hypothetical protein 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Leishmania major protein kinase, putative 0.0002 0 0.5
Brugia malayi Serotonin receptor 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Brugia malayi larval opioid receptor 0.0009 0.0236 0.5
Brugia malayi sulfakinin receptor protein 0.0009 0.0236 0.5
Brugia malayi GnHR receptor homolog 0.0009 0.0236 0.5
Brugia malayi RE15519p 0.0009 0.0236 0.5
Brugia malayi Dopamine receptor protein 2 0.0009 0.0236 0.5
Brugia malayi hypothetical protein 0.0009 0.0236 0.5
Schistosoma mansoni serine/threonine protein kinase 0.027 1 1
Entamoeba histolytica protein kinase, putative 0.027 1 1
Brugia malayi AKH receptor 0.0009 0.0236 0.5
Brugia malayi Dopamine receptor 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Brugia malayi putative neuropeptide receptor 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Brugia malayi hypothetical protein 0.0009 0.0236 0.5
Brugia malayi hypothetical protein 0.0009 0.0236 0.5
Brugia malayi Serotonin/octopamine receptor family protein 7 0.0009 0.0236 0.5
Brugia malayi gonadotropin-releasing hormone receptor 2 0.0009 0.0236 0.5
Brugia malayi Dopamine receptor protein 1, putative (partial) 0.0009 0.0236 0.5
Onchocerca volvulus Neuropeptide F receptor homolog 0.0009 0.0236 0.5
Echinococcus multilocularis serotonin receptor 0.0156 0.5724 0.5621
Brugia malayi hypothetical protein 0.0009 0.0236 0.5
Brugia malayi G protein-coupled receptor F59B2.13 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Loa Loa (eye worm) hypothetical protein 0.0156 0.5724 1
Brugia malayi Melatonin receptor type 1A 0.0009 0.0236 0.5
Brugia malayi G protein-coupled receptor 0.0009 0.0236 0.5
Trypanosoma cruzi STE/STE11 serine/threonine-protein kinase, putative 0.0002 0 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Brugia malayi G-protein coupled receptor 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Brugia malayi hypothetical protein 0.0009 0.0236 0.5
Leishmania major serine-threonine protein kinase-like protein 0.0002 0 0.5
Brugia malayi Unidentified vitellogenin-linked transcript protein 6, putative 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Echinococcus granulosus biogenic amine 5HT receptor 0.0156 0.5724 0.5621
Brugia malayi G-protein-linked acetylcholine receptor protein 2, putative 0.0009 0.0236 0.5
Brugia malayi hypothetical protein 0.0009 0.0236 0.5
Brugia malayi G-protein coupled receptor 0.0009 0.0236 0.5
Brugia malayi ORL1-like opioid receptor 0.0009 0.0236 0.5
Loa Loa (eye worm) hypothetical protein 0.0156 0.5724 1
Brugia malayi Serotonin receptor 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Brugia malayi putative neuropeptide receptor NPR1 0.0009 0.0236 0.5
Brugia malayi neuropeptide F receptor 0.0009 0.0236 0.5
Entamoeba histolytica protein kinase, putative 0.027 1 1
Brugia malayi follicle stimulating hormone receptor 0.0009 0.0236 0.5
Schistosoma mansoni biogenic amine (5HT) receptor 0.0156 0.5724 0.5621
Echinococcus multilocularis serine:threonine protein kinase Chk2 0.027 1 1
Leishmania major protein kinase, putative 0.0002 0 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Brugia malayi Tachykinin-like peptides receptor 99D 0.0009 0.0236 0.5
Leishmania major protein kinase, putative 0.0002 0 0.5
Trypanosoma brucei Forkhead Kinase, putative 0.0002 0 0.5
Brugia malayi hypothetical protein 0.0009 0.0236 0.5
Echinococcus multilocularis calcium:calmodulin dependent protein kinase I 0.027 0.9996 0.9996
Onchocerca volvulus 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Onchocerca volvulus 0.0009 0.0236 0.5
Brugia malayi hypothetical protein 0.0009 0.0236 0.5
Echinococcus granulosus calcium:calmodulin dependent protein kinase I 0.027 0.9996 0.9996
Onchocerca volvulus 0.0009 0.0236 0.5
Brugia malayi hypothetical protein 0.0009 0.0236 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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