Detailed information for compound 712358

Basic information

Technical information
  • TDR Targets ID: 712358
  • Name: 1-[3-(2-bromo-4-methylphenoxy)propyl]-4-ethyl piperazine
  • MW: 341.287 | Formula: C16H25BrN2O
  • H donors: 0 H acceptors: 0 LogP: 3.52 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN1CCN(CC1)CCCOc1ccc(cc1Br)C
  • InChi: 1S/C16H25BrN2O/c1-3-18-8-10-19(11-9-18)7-4-12-20-16-6-5-14(2)13-15(16)17/h5-6,13H,3-4,7-12H2,1-2H3
  • InChiKey: PBIPRJCAMWRVFN-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 1-[3-(2-bromo-4-methyl-phenoxy)propyl]-4-ethyl-piperazine

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) runx1 0.0063 0.0151 0.0148
Schistosoma mansoni glutamate receptor NMDA 0.0577 0.4577 0.4547
Echinococcus granulosus glutamate receptor NMDA 0.0505 0.3958 0.4293
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0049 0.0035 0.5
Schistosoma mansoni aldehyde dehydrogenase 0.0139 0.0807 0.0756
Echinococcus granulosus glutamate receptor ionotropic kainate 3 0.0243 0.1706 0.1828
Schistosoma mansoni protein kinase 0.0125 0.0685 0.0633
Onchocerca volvulus Huntingtin homolog 0.0138 0.0802 0.0364
Brugia malayi hypothetical protein 0.0138 0.0802 0.1155
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0071 0.0225 0.5
Echinococcus multilocularis lysine specific demethylase 5A 0.0066 0.0183 0.014
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0066 0.0183 0.014
Brugia malayi Receptor family ligand binding region containing protein 0.0125 0.0685 0.0973
Echinococcus granulosus glutamate receptor 2 0.0701 0.5652 0.6146
Echinococcus multilocularis metabotropic glutamate receptor 5 0.0125 0.0685 0.069
Schistosoma mansoni hypothetical protein 0.0381 0.2892 0.2852
Schistosoma mansoni hypothetical protein 0.0243 0.1706 0.166
Echinococcus granulosus receptor type guanylyl cyclase 0.0125 0.0685 0.071
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0071 0.0225 0.5
Echinococcus multilocularis geminin 0.0381 0.2892 0.3111
Schistosoma mansoni ATP-binding cassette transporter 0.0577 0.4577 0.4547
Echinococcus multilocularis metabotropic glutamate receptor 2 0.0125 0.0685 0.069
Echinococcus multilocularis glutamate receptor NMDA 0.0505 0.3958 0.428
Echinococcus granulosus metabotropic glutamate receptor 2 0.0125 0.0685 0.071
Trypanosoma cruzi extracellular receptor, putative 0.0125 0.0685 1
Echinococcus granulosus nmda type glutamate receptor 0.0629 0.5033 0.5469
Loa Loa (eye worm) receptor family ligand binding region containing protein 0.0125 0.0685 0.0973
Echinococcus granulosus lysine specific demethylase 5A 0.0066 0.0183 0.0161
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0049 0.0035 0.5
Trypanosoma cruzi cysteine peptidase, putative 0.0071 0.0225 0.2225
Loa Loa (eye worm) hypothetical protein 0.0803 0.6526 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0071 0.0225 0.5
Echinococcus multilocularis survival motor neuron protein 1 0.0803 0.6526 0.7097
Schistosoma mansoni hypothetical protein 0.0164 0.1021 0.0971
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0139 0.0807 0.0824
Echinococcus multilocularis nmda type glutamate receptor 0.111 0.9174 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0071 0.0225 0.5
Loa Loa (eye worm) glutamate receptor 1 0.0577 0.4577 0.6988
Echinococcus granulosus nmda type glutamate receptor 0.111 0.9174 1
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0701 0.5652 0.6146
Echinococcus granulosus metabotropic glutamate receptor 5 0.0125 0.0685 0.071
Echinococcus granulosus glutamate receptor subunit protein glur 0.0243 0.1706 0.1828
Loa Loa (eye worm) hypothetical protein 0.05 0.3921 0.5973
Schistosoma mansoni metabotropic glutamate receptor 0.0125 0.0685 0.0633
Trypanosoma cruzi cysteine peptidase, putative 0.0071 0.0225 0.2225
Entamoeba histolytica hypothetical protein 0.0125 0.0685 1
Chlamydia trachomatis glutamine binding protein 0.0362 0.2729 0.5
Echinococcus multilocularis glutamate (NMDA) receptor subunit 0.0577 0.4577 0.4959
Loa Loa (eye worm) hypothetical protein 0.0138 0.0802 0.1155
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0701 0.5652 0.6138
Echinococcus granulosus muscleblind protein 0.0169 0.1064 0.1125
Schistosoma mansoni glutamate receptor kainate 0.0577 0.4577 0.4547
Loa Loa (eye worm) hypothetical protein 0.0125 0.0685 0.0973
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0168 0.1056 0.1098
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0055 0.0022
Loa Loa (eye worm) hypothetical protein 0.0125 0.0685 0.0973
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.0055 0.0022
Brugia malayi Receptor family ligand binding region containing protein 0.0125 0.0685 0.0973
Mycobacterium tuberculosis Probable glutamine-binding lipoprotein GlnH (GLNBP) 0.0362 0.2729 1
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0701 0.5652 0.6138
Onchocerca volvulus 0.05 0.3921 1
Chlamydia trachomatis arginine ABC transporter substrate-binding protein ArtJ 0.0362 0.2729 0.5
Loa Loa (eye worm) hypothetical protein 0.05 0.3921 0.5973
Loa Loa (eye worm) RGC/RGC protein kinase 0.0125 0.0685 0.0973
Brugia malayi Muscleblind-like protein 0.0169 0.1064 0.1559
Loa Loa (eye worm) metabotropic glutamate receptor 8 0.0125 0.0685 0.0973
Echinococcus multilocularis atrial natriuretic peptide receptor 0.0125 0.0685 0.069
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0164 0.1021 0.1492
Echinococcus multilocularis Protein lozenge 0.0063 0.0151 0.0105
Echinococcus multilocularis glutamate receptor 2 0.0458 0.3556 0.3839
Loa Loa (eye worm) acetyltransferase 0.0168 0.1056 0.1547
Echinococcus multilocularis tyrosine kinase 0.0125 0.0685 0.069
Loa Loa (eye worm) metabotropic GABA-B receptor subtype 2 0.0125 0.0685 0.0973
Brugia malayi Glutamate receptor 2 precursor 0.0577 0.4577 0.6988
Loa Loa (eye worm) hypothetical protein 0.0125 0.0685 0.0973
Echinococcus granulosus histone acetyltransferase KAT2B 0.0163 0.1016 0.1073
Brugia malayi Guanylyl cyclase protein 23 0.0125 0.0685 0.0973
Brugia malayi metabotropic glutamate receptor type 2 0.0125 0.0685 0.0973
Schistosoma mansoni glutamate receptor kainate 0.0577 0.4577 0.4547
Loa Loa (eye worm) hypothetical protein 0.0169 0.1064 0.1559
Echinococcus granulosus tyrosine kinase 0.0125 0.0685 0.071
Loa Loa (eye worm) glutamate receptor 2 0.0577 0.4577 0.6988
Echinococcus granulosus glutamate receptor ionotropic kainate 0.0243 0.1706 0.1828
Brugia malayi hypothetical protein 0.0803 0.6526 1
Echinococcus multilocularis receptor type guanylyl cyclase 0.0125 0.0685 0.069
Schistosoma mansoni survival motor neuron protein 0.0164 0.1021 0.0971
Schistosoma mansoni glutamate receptor AMPA 0.0577 0.4577 0.4547
Brugia malayi jmjC domain containing protein 0.0066 0.0183 0.0197
Loa Loa (eye worm) hypothetical protein 0.0125 0.0685 0.0973
Toxoplasma gondii aldehyde dehydrogenase 0.0139 0.0807 1
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0168 0.1056 0.1007
Echinococcus granulosus geminin 0.0381 0.2892 0.3126
Treponema pallidum amino acid ABC transporter, periplasmic binding protein (hisJ) 0.0362 0.2729 0.5
Giardia lamblia Histone acetyltransferase GCN5 0.0045 0 0.5
Brugia malayi metabotropic GABA-B receptor subtype 2 0.0125 0.0685 0.0973
Brugia malayi acetyltransferase, GNAT family protein 0.0168 0.1056 0.1547
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0071 0.0225 0.5
Loa Loa (eye worm) hypothetical protein 0.0125 0.0685 0.0973
Echinococcus multilocularis muscleblind protein 1 0.0169 0.1064 0.1106
Echinococcus multilocularis glutamate receptor 2 0.0701 0.5652 0.6138
Trypanosoma cruzi cysteine peptidase, putative 0.0071 0.0225 0.2225
Echinococcus granulosus glutamate receptor 2 0.0458 0.3556 0.3852
Brugia malayi jmjC domain containing protein 0.0066 0.0183 0.0197
Echinococcus granulosus Ribosomal protein S1 RNA binding domain 0.0243 0.1706 0.1828
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0701 0.5652 0.6146
Loa Loa (eye worm) hypothetical protein 0.0125 0.0685 0.0973
Echinococcus granulosus survival motor neuron protein 1 0.0803 0.6526 0.7103
Loa Loa (eye worm) glutamate receptor 0.0125 0.0685 0.0973
Trypanosoma cruzi cruzipain precursor, putative 0.0071 0.0225 0.2225
Echinococcus multilocularis microtubule associated protein 2 0.0772 0.626 0.6804
Schistosoma mansoni lozenge 0.0063 0.0151 0.0096
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0071 0.0225 0.5
Echinococcus multilocularis glutamate receptor subunit protein glur 0.0243 0.1706 0.1811
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0066 0.0183 0.0161
Echinococcus granulosus microtubule associated protein 2 0.0772 0.626 0.6811
Brugia malayi hypothetical protein 0.0125 0.0685 0.0973
Echinococcus multilocularis NMDA receptor 0.0243 0.1706 0.1811
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0071 0.0225 0.5
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 3 0.0605 0.4826 0.5232
Brugia malayi Glutamate receptor 1 precursor 0.0577 0.4577 0.6988
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0139 0.0807 1
Loa Loa (eye worm) hypothetical protein 0.0138 0.0802 0.1155
Schistosoma mansoni hypothetical protein 0.0381 0.2892 0.2852
Echinococcus multilocularis glutamate receptor ionotropic kainate 0.0243 0.1706 0.1811
Loa Loa (eye worm) hypothetical protein 0.0125 0.0685 0.0973
Echinococcus multilocularis muscleblind protein 0.0169 0.1064 0.1106
Loa Loa (eye worm) hypothetical protein 0.0125 0.0685 0.0973
Echinococcus multilocularis glutamate receptor 2 0.0577 0.4577 0.4959
Schistosoma mansoni glutamate receptor kainate 0.0577 0.4577 0.4547
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0071 0.0225 0.5
Schistosoma mansoni microtubule-associated protein tau 0.0772 0.626 0.6239
Schistosoma mansoni jumonji/arid domain-containing protein 0.0066 0.0183 0.0128
Schistosoma mansoni glutamate receptor AMPA 0.0577 0.4577 0.4547
Schistosoma mansoni jumonji/arid domain-containing protein 0.0066 0.0183 0.0128
Echinococcus granulosus glutamate receptor ionotrophic AMPA 3 0.0701 0.5652 0.6146
Echinococcus granulosus atrial natriuretic peptide receptor 0.0125 0.0685 0.071
Echinococcus multilocularis Ribosomal protein S1, RNA binding domain 0.0243 0.1706 0.1811
Schistosoma mansoni jumonji domain containing protein 0.0066 0.0183 0.0128
Echinococcus granulosus Glutamate receptor ionotropic kainate 2 0.0701 0.5652 0.6146
Onchocerca volvulus Huntingtin homolog 0.0138 0.0802 0.0364
Loa Loa (eye worm) RGC/RGC protein kinase 0.0125 0.0685 0.0973
Echinococcus granulosus glutamate NMDA receptor subunit 0.0577 0.4577 0.497
Schistosoma mansoni tyrosine kinase 0.0125 0.0685 0.0633
Brugia malayi hypothetical protein 0.05 0.3921 0.5973
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0065 0.0172 0.1323
Treponema pallidum amino acid ABC transporter, periplasmic binding protein 0.0362 0.2729 0.5
Schistosoma mansoni tyrosine kinase 0.0125 0.0685 0.0633
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0071 0.0225 0.5
Loa Loa (eye worm) hypothetical protein 0.0125 0.0685 0.0973
Echinococcus multilocularis Glutamate receptor, ionotropic kainate 2 0.0701 0.5652 0.6138
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0071 0.0225 0.5
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0139 0.0807 0.0844
Leishmania major extracellular receptor, putative 0.0125 0.0685 0.79
Onchocerca volvulus 0.0164 0.1021 0.1039
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0071 0.0225 0.5
Loa Loa (eye worm) hypothetical protein 0.0169 0.1064 0.1559
Schistosoma mansoni metabotropic glutamate receptor 0.0125 0.0685 0.0633
Plasmodium falciparum histone acetyltransferase GCN5 0.0045 0 0.5
Echinococcus multilocularis glutamate receptor, ionotrophic, AMPA 3 0.0701 0.5652 0.6138
Loa Loa (eye worm) RGC/RGC protein kinase 0.0125 0.0685 0.0973
Schistosoma mansoni aldehyde dehydrogenase 0.0139 0.0807 0.0756
Echinococcus multilocularis nmda type glutamate receptor 0.0629 0.5033 0.5459
Loa Loa (eye worm) jmjC domain-containing protein 0.0066 0.0183 0.0197
Mycobacterium ulcerans glutamine-binding lipoprotein GlnH 0.0362 0.2729 1
Brugia malayi Metabotropic glutamate receptor precursor. 0.0125 0.0685 0.0973
Trichomonas vaginalis bromodomain-containing protein, putative 0.0049 0.0035 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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