Detailed information for compound 1634209

Basic information

Technical information
  • TDR Targets ID: 1634209
  • Name: N-[2-(4-bromophenyl)ethyl]-N',N'-diethyl-N-me thylethane-1,2-diamine
  • MW: 313.276 | Formula: C15H25BrN2
  • H donors: 0 H acceptors: 0 LogP: 3.68 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN(CCN(CCc1ccc(cc1)Br)C)CC
  • InChi: 1S/C15H25BrN2/c1-4-18(5-2)13-12-17(3)11-10-14-6-8-15(16)9-7-14/h6-9H,4-5,10-13H2,1-3H3
  • InChiKey: ZYAFZLQLJCCMKE-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[2-(4-bromophenyl)ethyl]-N',N'-diethyl-N-methyl-ethane-1,2-diamine
  • 2-(4-bromophenyl)ethyl-(2-diethylaminoethyl)-methyl-amine
  • N~1~-(2-(4-Bromophenyl)ethyl)-N~2~,N~2~-diethyl-N~1~-methyl-1,2-ethanediamine hydrobromide
  • NSC665370 (HYDOBROMIDE SALT)
  • AIDS-158260
  • NCI60_022569
  • AIDS158260

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
Trichomonas vaginalis PIKK family atypical protein kinase 0.1849 0.0356 0.032
Trichomonas vaginalis PIKK family atypical protein kinase 0.2277 0.0663 0.1248
Schistosoma mansoni sodium/calcium exchanger 1.5316 1 1
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor2 0.2999 0.118 0.2533
Trichomonas vaginalis PIKK family atypical protein kinase 0.2423 0.0767 0.1562
Loa Loa (eye worm) phosphatidylinositol 3 1.0476 0.6534 0.64
Loa Loa (eye worm) hypothetical protein 0.4159 0.201 0.1701
Trichomonas vaginalis PIKK family atypical protein kinase 0.1703 0.0251 0.0005
Entamoeba histolytica hypothetical protein 0.5068 0.2661 0.6931
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.2999 0.118 0.1869
Trichomonas vaginalis PIKK family atypical protein kinase 0.2423 0.0767 0.1562
Echinococcus multilocularis phosphatidylinositol 4,5 bisphosphate 3 kinase 1.173 0.7432 0.7088
Trichomonas vaginalis PIKK family atypical protein kinase 0.1865 0.0368 0.0356
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.2905 0.1112 0.1637
Schistosoma mansoni phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K 1.173 0.7432 0.7258
Trichomonas vaginalis PIKK family atypical protein kinase 0.2072 0.0515 0.0803
Trichomonas vaginalis PIKK family atypical protein kinase 0.2277 0.0663 0.1248
Trypanosoma brucei phosphatidylinositol 3-kinase, putative 0.2236 0.0633 0.5364
Entamoeba histolytica FKBP-rapamycin associated protein (FRAP), putative 0.2999 0.118 0.1869
Trichomonas vaginalis PIKK family atypical protein kinase 0.2423 0.0767 0.1562
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.6322 0.3559 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.1849 0.0356 0.032
Brugia malayi Sodium/calcium exchanger protein 0.6127 0.3419 0.9523
Trichomonas vaginalis PIKK family atypical protein kinase 0.2277 0.0663 0.1248
Trichomonas vaginalis PIKK family atypical protein kinase 0.2277 0.0663 0.1248
Trichomonas vaginalis PIKK family atypical protein kinase 0.2277 0.0663 0.1248
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.2236 0.0633 0.1157
Trichomonas vaginalis PIKK family atypical protein kinase 0.1703 0.0251 0.0005
Leishmania major target of rapamycin (TOR) kinase 2, putative 0.2999 0.118 1
Giardia lamblia GTOR 0.2999 0.118 0.9047
Trypanosoma brucei phosphatidylinositol 3-kinase tor, putative 0.1514 0.0116 0.0985
Trichomonas vaginalis PIKK family atypical protein kinase 0.2423 0.0767 0.1562
Trypanosoma cruzi Phosphatidylinositol 3-kinase tor1 0.2999 0.118 0.2533
Trichomonas vaginalis PIKK family atypical protein kinase 0.1703 0.0251 0.0005
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.4399 0.2182 0.5839
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.6322 0.3559 1
Trypanosoma brucei Phosphatidylinositol 3-kinase tor1 0.2999 0.118 1
Trichomonas vaginalis alpha-L-fucosidase, putative 0.2702 0.0966 0.2166
Trichomonas vaginalis PIKK family atypical protein kinase 0.2277 0.0663 0.1248
Echinococcus multilocularis phosphatidylinositol 4 phosphate 3 kinase C2 0.4159 0.201 0.0941
Brugia malayi Phosphatidylinositol 3- and 4-kinase family protein 0.4159 0.201 0.4706
Trichomonas vaginalis PIKK family atypical protein kinase 0.2011 0.0472 0.0671
Schistosoma mansoni ataxia telangiectasia mutated (atm)-related 0.2999 0.118 0.0584
Trichomonas vaginalis PIKK family atypical protein kinase 0.2587 0.0885 0.1918
Trichomonas vaginalis PIKK family atypical protein kinase 0.1703 0.0251 0.0005
Loa Loa (eye worm) hypothetical protein 0.6127 0.3419 0.3165
Echinococcus granulosus phosphatidylinositol 45 bisphosphate 3 kinase 1.173 0.7432 0.7088
Loa Loa (eye worm) hypothetical protein 0.2163 0.0581 0.0217
Echinococcus multilocularis sodium calcium exchanger 1.5316 1 1
Trichomonas vaginalis alpha-L-fucosidase, putative 0.2702 0.0966 0.2166
Leishmania major target of rapamycin (TOR) kinase 1, putative 0.2999 0.118 1
Toxoplasma gondii target of rapamycin (TOR), putative 0.2277 0.0663 0.5
Trypanosoma cruzi phosphatidylinositol 3-kinase vps34-like 0.2236 0.0633 0.0817
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.6322 0.3559 1
Trichomonas vaginalis PIKK family atypical protein kinase 0.2999 0.118 0.281
Trichomonas vaginalis PIKK family atypical protein kinase 0.2999 0.118 0.281
Trichomonas vaginalis phosphatidylinositol kinase, putative 0.2236 0.0633 0.1157
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.6322 0.3559 1
Trichomonas vaginalis phosphatidylinositol 3-kinase class, putative 0.4399 0.2182 0.5839
Trichomonas vaginalis phopsphatidylinositol 3-kinase, drosophila, putative 0.6322 0.3559 1
Trypanosoma brucei phosphatidylinositol 4-kinase, putative 0.2999 0.118 1
Loa Loa (eye worm) phosphatidylinositol 3 0.2999 0.118 0.0838
Entamoeba histolytica phosphatidylinositol 3-kinase 1, putative 0.5958 0.3299 0.911
Echinococcus granulosus phosphatidylinositol 4 phosphate 3 kinase C2 0.4159 0.201 0.0941
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative 0.2236 0.0633 0.1157
Trichomonas vaginalis PIKK family atypical protein kinase 0.1865 0.0368 0.0356
Giardia lamblia Phosphoinositide-3-kinase, catalytic, alpha polypeptide 0.3145 0.1284 1
Entamoeba histolytica phosphatidylinositol 3-kinase, putative 0.5068 0.2661 0.6931
Trichomonas vaginalis PIKK family atypical protein kinase 0.2277 0.0663 0.1248
Trypanosoma brucei target of rapamycin kinase 3, putative 0.2425 0.0768 0.6514
Trichomonas vaginalis PIKK family atypical protein kinase 0.2999 0.118 0.281
Trichomonas vaginalis PIKK family atypical protein kinase 0.2423 0.0767 0.1562
Trichomonas vaginalis PIKK family atypical protein kinase 0.1865 0.0368 0.0356
Loa Loa (eye worm) solute carrier family 8 1.5316 1 1
Trypanosoma cruzi phosphatidylinositol 3-kinase 2, putative 0.6322 0.3559 1
Trichomonas vaginalis phosphatidylinositol 3-kinase catalytic subunit gamma, putative 0.6322 0.3559 1
Brugia malayi phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative 0.5408 0.2905 0.7764
Trypanosoma cruzi target of rapamycin kinase 3 0.2425 0.0768 0.1243
Entamoeba histolytica phosphatidylinositol3-kinaseTor2, putative 0.2999 0.118 0.1869

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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