Detailed information for compound 1733628

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 455.376 | Formula: C25H24Cl2N2O2
  • H donors: 0 H acceptors: 0 LogP: 6.42 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: Clc1ccc(c(c1)Cl)COc1ccccc1/C=N/OC1CCN(C1)Cc1ccccc1
  • InChi: 1S/C25H24Cl2N2O2/c26-22-11-10-21(24(27)14-22)18-30-25-9-5-4-8-20(25)15-28-31-23-12-13-29(17-23)16-19-6-2-1-3-7-19/h1-11,14-15,23H,12-13,16-18H2/b28-15+
  • InChiKey: OEJHEFCUZOWJRG-RWPZCVJISA-N  

Network

Hover on a compound node to display the structore

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
Brugia malayi Immunoglobulin I-set domain containing protein 0.0342 0.0417 0.0412
Brugia malayi Immunoglobulin I-set domain containing protein 0.0029 0.0016 0.0011
Loa Loa (eye worm) hypothetical protein 0.7818 1 1
Schistosoma mansoni neuroglian 0.002 0.0005 0.0005
Echinococcus granulosus twitchin 0.0026 0.0013 0.0008
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0342 0.0417 0.0412
Echinococcus multilocularis alpha 1,6 mannosyl glycoprotein 0.7818 1 1
Echinococcus granulosus defective proboscis extension response 0.0021 0.0006 0.0001
Schistosoma mansoni cell adhesion molecule 0.0036 0.0025 0.0025
Loa Loa (eye worm) hypothetical protein 0.0033 0.0021 0.0016
Echinococcus granulosus alpha 16 mannosyl glycoprotein 0.7818 1 1
Loa Loa (eye worm) hypothetical protein 0.0021 0.0006 0.0001
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.0028 0.0014 0.001
Schistosoma mansoni beta-12-n-acetylglucosaminyltransferase II 0.7818 1 1
Schistosoma mansoni vesicular amine transporter 0.0021 0.0006 0.0006
Loa Loa (eye worm) hypothetical protein 0.0033 0.0021 0.0016
Loa Loa (eye worm) hypothetical protein 0.0029 0.0016 0.0011
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.0021 0.0006 0.0006
Onchocerca volvulus Tyrosine kinase homolog 0.0319 0.0388 1
Echinococcus granulosus neuroglian 0.0026 0.0013 0.0008
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.002 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0021 0.0006 0.0001
Echinococcus multilocularis basement membrane specific heparan sulfate 0.0021 0.0006 0.0001
Loa Loa (eye worm) hypothetical protein 0.0029 0.0016 0.0011
Loa Loa (eye worm) hypothetical protein 0.0021 0.0006 0.0001
Schistosoma mansoni nephrin 0.0034 0.0023 0.0023
Schistosoma mansoni Neurotrimin precursor (hNT) 0.0021 0.0006 0.0006
Echinococcus multilocularis neuroglian 0.0026 0.0013 0.0008
Brugia malayi Fibronectin type III domain containing protein 0.0029 0.0016 0.0011
Brugia malayi hypothetical protein 0.0029 0.0016 0.0011
Echinococcus multilocularis roundabout 2 0.0041 0.0032 0.0027
Loa Loa (eye worm) hypothetical protein 0.0029 0.0016 0.0011
Echinococcus granulosus Immunoglobulin 0.0021 0.0006 0.0001
Echinococcus multilocularis Immunoglobulin 0.0021 0.0006 0.0001
Schistosoma mansoni cell adhesion molecule 0.002 0.0005 0.0005
Echinococcus multilocularis Immunoglobulin 0.0021 0.0006 0.0001
Schistosoma mansoni cell adhesion molecule 0.002 0.0005 0.0005
Loa Loa (eye worm) hypothetical protein 0.0028 0.0014 0.001
Schistosoma mansoni nephrin 0.002 0.0005 0.0005
Echinococcus granulosus roundabout 2 0.0041 0.0032 0.0027

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.