Detailed information for compound 660866

Basic information

Technical information
  • TDR Targets ID: 660866
  • Name: 4-[3-(2-bromophenoxy)propyl]-2,6-dimethylmorp holine
  • MW: 328.245 | Formula: C15H22BrNO2
  • H donors: 0 H acceptors: 0 LogP: 3.47 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC1CN(CCCOc2ccccc2Br)CC(O1)C
  • InChi: 1S/C15H22BrNO2/c1-12-10-17(11-13(2)19-12)8-5-9-18-15-7-4-3-6-14(15)16/h3-4,6-7,12-13H,5,8-11H2,1-2H3
  • InChiKey: GWTQPPDNBSYBSA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-[3-(2-bromophenoxy)propyl]-2,6-dimethyl-morpholine

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
Chlamydia trachomatis neutral amino acid transporter 0.0341 0.4313 0.4305
Echinococcus multilocularis neutral amino acid transporter excitatory amino acid transporter 0.0341 0.4313 0.2864
Echinococcus multilocularis neutral amino acid transporter A 0.077 1 1
Treponema pallidum glutamate/aspartate transporter 0.0341 0.4313 0.5
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0089 0.5
Mycobacterium tuberculosis Probable C4-dicarboxylate-transport transmembrane protein DctA 0.077 1 1
Loa Loa (eye worm) hypothetical protein 0.0048 0.042 0.0408
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0089 0.5
Echinococcus granulosus neutral amino acid transporter A 0.077 1 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0023 0.0089 1
Echinococcus multilocularis tumor protein p63 0.0327 0.4127 0.263
Echinococcus multilocularis neutral amino acid transporter excitatory amino acid transporter 0.077 1 1
Loa Loa (eye worm) excitatory amino acid transporter 0.077 1 1
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0089 0.5
Leishmania major 4-coumarate:coa ligase-like protein 0.0023 0.0089 0.5
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0023 0.0089 0.0089
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0023 0.0089 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0089 1
Schistosoma mansoni hypothetical protein 0.0169 0.203 0.1837
Echinococcus multilocularis Excitatory amino acid transporter 0.077 1 1
Echinococcus granulosus tumor protein p63 0.0327 0.4127 0.263
Echinococcus multilocularis sodium:dicarboxylate symporter 0.077 1 1
Loa Loa (eye worm) hypothetical protein 0.0023 0.0089 0.0077
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0023 0.0089 0.5
Echinococcus granulosus sodium:dicarboxylate symporter 0.077 1 1
Schistosoma mansoni sodium/dicarboxylate symporter-related 0.0341 0.4313 0.4175
Echinococcus multilocularis excitatory amino acid transporter 2 0.077 1 1
Echinococcus granulosus excitatory amino acid transporter 2 0.077 1 1
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0023 0.0089 0.0089
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0023 0.0089 1
Echinococcus granulosus Excitatory amino acid transporter 0.077 1 1
Echinococcus granulosus Excitatory amino acid transporter 0.077 1 1
Echinococcus multilocularis excitatory amino acid transporter 3 0.077 1 1
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0089 0.5
Treponema pallidum glutamate transporter 0.0341 0.4313 0.5
Echinococcus multilocularis neutral amino acid transporter A 0.077 1 1
Echinococcus granulosus neutral amino acid transporter A 0.077 1 1
Schistosoma mansoni sodium/dicarboxylate symporter-related 0.0341 0.4313 0.4175
Entamoeba histolytica acyl-coA synthetase, putative 0.0023 0.0089 0.5
Echinococcus granulosus neutral amino acid transporter 0.077 1 1
Echinococcus granulosus excitatory amino acid transporter 2 0.077 1 1
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.0236 0.0148
Schistosoma mansoni hypothetical protein 0.0169 0.203 0.1837
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.0445 0.0434
Echinococcus multilocularis Excitatory amino acid transporter 0.077 1 1
Onchocerca volvulus 0.0048 0.042 0.0334
Loa Loa (eye worm) hypothetical protein 0.005 0.0445 0.0434
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0089 1
Echinococcus multilocularis neutral amino acid transporter A 0.077 1 1
Mycobacterium ulcerans hypothetical protein 0.0023 0.0089 1
Echinococcus granulosus excitatory amino acid transporter 3 0.077 1 1
Entamoeba histolytica acyl-CoA synthetase, putative 0.0023 0.0089 0.5
Wolbachia endosymbiont of Brugia malayi Na+/H+-dicarboxylate symporter 0.077 1 0.5
Schistosoma mansoni solute carrier family 1 (glial high affinity glutamate transporter 0.077 1 1
Chlamydia trachomatis glutamate symporter 0.077 1 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0236 0.0224
Plasmodium falciparum acyl-CoA synthetase 0.0017 0.0012 0.5
Loa Loa (eye worm) hypothetical protein 0.0023 0.0089 0.0077
Echinococcus multilocularis sodium:dicarboxylate symporter 0.0341 0.4313 0.2864
Mycobacterium ulcerans acyl-CoA synthetase 0.0023 0.0089 1
Onchocerca volvulus Excitatory amino acid transporter homolog 0.077 1 1
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.0445 0.0359
Loa Loa (eye worm) hypothetical protein 0.0023 0.0089 0.0077
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0017 0.0012 0.0012
Echinococcus multilocularis excitatory amino acid transporter 2 0.077 1 1
Plasmodium vivax acyl-CoA synthetase, putative 0.0017 0.0012 0.5
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0023 0.0089 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.0445 0.0359
Schistosoma mansoni cellular tumor antigen P53 0.0048 0.042 0.0188

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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