Detailed information for compound 739221

Basic information

Technical information
  • TDR Targets ID: 739221
  • Name: N-(3-bromophenyl)-1-propylsulfonylpiperidine- 3-carboxamide
  • MW: 389.308 | Formula: C15H21BrN2O3S
  • H donors: 1 H acceptors: 3 LogP: 2.43 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCS(=O)(=O)N1CCCC(C1)C(=O)Nc1cccc(c1)Br
  • InChi: 1S/C15H21BrN2O3S/c1-2-9-22(20,21)18-8-4-5-12(11-18)15(19)17-14-7-3-6-13(16)10-14/h3,6-7,10,12H,2,4-5,8-9,11H2,1H3,(H,17,19)
  • InChiKey: OEKOEPJEDVWRCU-UHFFFAOYSA-N  

Network

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Synonyms

  • N-(3-bromophenyl)-1-propylsulfonyl-piperidine-3-carboxamide
  • N-(3-bromophenyl)-1-propylsulfonyl-3-piperidinecarboxamide
  • N-(3-bromophenyl)-1-propylsulfonyl-nipecotamide

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) hypothetical protein 0.0158 0.1721 0.1675
Schistosoma mansoni hypothetical protein 0.0069 0.0404 0.0351
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0322 0.4149 1
Onchocerca volvulus 0.0067 0.037 0.4958
Toxoplasma gondii PHD-finger domain-containing protein 0.0092 0.0745 0.5
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0157 0.1709 0.5
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0322 0.4149 1
Trichomonas vaginalis chromobox protein, putative 0.0069 0.0408 0.0984
Echinococcus multilocularis survival motor neuron protein 1 0.0232 0.2816 0.2776
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0047 0.0081 0.0061
Echinococcus granulosus geminin 0.0352 0.459 0.456
Echinococcus granulosus lysine specific demethylase 5A 0.0112 0.1033 0.0983
Echinococcus granulosus PHD finger protein rhinoceros 0.0092 0.0745 0.0694
Echinococcus granulosus chromobox protein 1 0.0069 0.0408 0.0355
Brugia malayi bZIP transcription factor family protein 0.0085 0.064 0.1391
Echinococcus granulosus jun protein 0.0085 0.064 0.0589
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0157 0.1709 0.5
Schistosoma mansoni hypothetical protein 0.0352 0.459 0.456
Echinococcus multilocularis lysine specific demethylase 5A 0.0112 0.1033 0.0983
Onchocerca volvulus Alhambra homolog 0.0092 0.0745 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0322 0.4149 1
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0717 1 1
Echinococcus multilocularis chromobox protein 1 0.0069 0.0408 0.0355
Loa Loa (eye worm) hypothetical protein 0.0232 0.2816 0.2776
Loa Loa (eye worm) hypothetical protein 0.0108 0.0979 0.0929
Echinococcus multilocularis jumonji domain containing protein 0.0128 0.128 0.1232
Brugia malayi Cytochrome P450 family protein 0.0049 0.0112 0.0135
Brugia malayi hypothetical protein 0.0067 0.037 0.0748
Loa Loa (eye worm) cytochrome P450 family protein 0.0049 0.0112 0.0057
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0108 0.0979 0.2196
Loa Loa (eye worm) PHD-finger family protein 0.0092 0.0745 0.0694
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0322 0.4149 1
Loa Loa (eye worm) jmjC domain-containing protein 0.0112 0.1033 0.0983
Schistosoma mansoni lipoxygenase 0.012 0.115 0.1101
Schistosoma mansoni hypothetical protein 0.0352 0.459 0.456
Schistosoma mansoni lipoxygenase 0.0084 0.0617 0.0566
Echinococcus granulosus survival motor neuron protein 1 0.0232 0.2816 0.2776
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0302 0.3852 0.3819
Loa Loa (eye worm) hypothetical protein 0.0092 0.0745 0.0694
Brugia malayi Heterochromatin protein 1 0.0069 0.0408 0.084
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.012 0.115 0.1101
Loa Loa (eye worm) heterochromatin protein 1 0.0069 0.0408 0.0355
Echinococcus granulosus peregrin 0.0092 0.0745 0.0694
Echinococcus multilocularis geminin 0.0352 0.459 0.456
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0092 0.0745 0.0694
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0717 1 1
Echinococcus multilocularis peregrin 0.0092 0.0745 0.0694
Echinococcus granulosus chromobox protein 1 0.0069 0.0408 0.0355
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0085 0.064 0.0589
Schistosoma mansoni chromobox protein 0.0069 0.0408 0.0355
Loa Loa (eye worm) hypothetical protein 0.0083 0.0606 0.0554
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0322 0.4149 1
Schistosoma mansoni hypothetical protein 0.0092 0.0745 0.0694
Schistosoma mansoni chromobox protein 0.0069 0.0408 0.0355
Schistosoma mansoni jumonji/arid domain-containing protein 0.0112 0.1033 0.0983
Schistosoma mansoni hypothetical protein 0.0074 0.0473 0.042
Loa Loa (eye worm) jmjC domain-containing protein 0.019 0.2199 0.2156
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0322 0.4149 1
Echinococcus granulosus arachidonate 5 lipoxygenase 0.012 0.115 0.1101
Echinococcus granulosus jumonji domain containing protein 0.0128 0.128 0.1232
Plasmodium falciparum phd finger protein, putative 0.0092 0.0745 0.5
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0085 0.064 0.0589
Brugia malayi PHD-finger family protein 0.0092 0.0745 0.1641
Plasmodium vivax hypothetical protein, conserved 0.0092 0.0745 0.5
Giardia lamblia Fructose-bisphosphate aldolase 0.0322 0.4149 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0322 0.4149 1
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0717 1 1
Brugia malayi jmjC domain containing protein 0.0302 0.3852 0.9026
Brugia malayi hypothetical protein 0.0232 0.2816 0.6562
Loa Loa (eye worm) hypothetical protein 0.0074 0.0473 0.042
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0108 0.0979 0.0929
Brugia malayi Bromodomain containing protein 0.0092 0.0745 0.1641
Schistosoma mansoni jumonji/arid domain-containing protein 0.0112 0.1033 0.0983
Schistosoma mansoni survival motor neuron protein 0.0047 0.0081 0.0026
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0322 0.4149 0.5
Brugia malayi Calcitonin receptor-like protein seb-1 0.0108 0.0979 0.2196
Treponema pallidum fructose-bisphosphate aldolase 0.0322 0.4149 0.5
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0157 0.1709 0.5
Schistosoma mansoni jun-related protein 0.0069 0.0404 0.0351
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0302 0.3852 0.3819
Echinococcus multilocularis chromobox protein 1 0.0069 0.0408 0.0355
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0322 0.4149 0.5
Trichomonas vaginalis chromobox protein, putative 0.0069 0.0408 0.0984
Schistosoma mansoni jumonji domain containing protein 0.024 0.2933 0.2894
Onchocerca volvulus 0.0047 0.0081 0.1081
Echinococcus multilocularis PHD finger protein rhinoceros 0.0092 0.0745 0.0694
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0322 0.4149 1
Toxoplasma gondii PHD-finger domain-containing protein 0.0092 0.0745 0.5
Schistosoma mansoni hypothetical protein 0.0047 0.0081 0.0026
Echinococcus multilocularis jun protein 0.0085 0.064 0.0589
Brugia malayi hypothetical protein 0.033 0.4262 1
Brugia malayi latrophilin 2 splice variant baaae 0.0074 0.0473 0.0993
Brugia malayi jmjC domain containing protein 0.0112 0.1033 0.2324

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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