Detailed information for compound 909932

Basic information

Technical information
  • TDR Targets ID: 909932
  • Name: N-(4-bromophenyl)-2-(4-phenylsulfonylpiperazi n-1-yl)acetamide
  • MW: 438.339 | Formula: C18H20BrN3O3S
  • H donors: 1 H acceptors: 3 LogP: 2.48 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccc(cc1)Br)CN1CCN(CC1)S(=O)(=O)c1ccccc1
  • InChi: 1S/C18H20BrN3O3S/c19-15-6-8-16(9-7-15)20-18(23)14-21-10-12-22(13-11-21)26(24,25)17-4-2-1-3-5-17/h1-9H,10-14H2,(H,20,23)
  • InChiKey: KUXNMVFQQKXPGC-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-(4-bromophenyl)-2-(4-phenylsulfonyl-1-piperazinyl)acetamide
  • N-(4-bromophenyl)-2-(4-phenylsulfonylpiperazin-1-yl)ethanamide

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
Entamoeba histolytica hypothetical protein 0.0036 0.145 0.1863
Entamoeba histolytica hypothetical protein 0.0036 0.145 0.1863
Mycobacterium ulcerans hypothetical protein 0.0024 0.0525 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.0525 0.0455
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0036 0.145 0.017
Entamoeba histolytica hypothetical protein 0.009 0.5489 1
Brugia malayi RNA recognition motif domain containing protein 0.0064 0.3513 0.3154
Onchocerca volvulus 0.0024 0.0525 0.5
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0024 0.0525 1
Loa Loa (eye worm) hypothetical protein 0.009 0.5432 0.5398
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0525 1
Echinococcus multilocularis tar DNA binding protein 0.0064 0.3513 0.2543
Brugia malayi hypothetical protein 0.0036 0.145 0.0976
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.0525 0.5
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0024 0.0525 1
Entamoeba histolytica protein kinase, putative 0.009 0.5489 1
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0024 0.0525 1
Echinococcus multilocularis muscleblind protein 1 0.0151 1 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0024 0.0525 1
Echinococcus multilocularis dual specificity 0.009 0.5489 0.4815
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0073 0.139
Schistosoma mansoni hypothetical protein 0.0036 0.145 0.0354
Entamoeba histolytica protein kinase, putative 0.009 0.5489 1
Schistosoma mansoni tar DNA-binding protein 0.0064 0.3513 0.5281
Loa Loa (eye worm) RNA binding protein 0.0064 0.3513 0.3466
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.009 0.5489 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0525 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0064 0.3513 0.3466
Plasmodium vivax double-strand break repair protein MRE11, putative 0.0034 0.127 1
Schistosoma mansoni serine/threonine protein kinase 0.009 0.5489 1
Entamoeba histolytica hypothetical protein 0.0036 0.145 0.1863
Trichomonas vaginalis nuclease Mre11 0.0034 0.1302 0.5
Trypanosoma cruzi CMGC/DYRK protein kinase, putative 0.009 0.5489 1
Entamoeba histolytica double-strand break repair protein MRE11, putative 0.0034 0.1302 0.1565
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.0525 0.5
Plasmodium falciparum double-strand break repair protein MRE11 0.0034 0.127 1
Loa Loa (eye worm) hypothetical protein 0.009 0.5432 0.5398
Trypanosoma brucei CMGC/DYRK protein kinase, putative 0.009 0.5489 1
Loa Loa (eye worm) TAR-binding protein 0.0064 0.3513 0.3466
Loa Loa (eye worm) hypothetical protein 0.0151 1 1
Schistosoma mansoni tar DNA-binding protein 0.0064 0.3513 0.5281
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0024 0.0525 1
Giardia lamblia Mre11, putative 0.0019 0.0145 0.5
Echinococcus granulosus dual specificity 0.009 0.5489 0.4815
Echinococcus granulosus tar DNA binding protein 0.0064 0.3513 0.2543
Loa Loa (eye worm) hypothetical protein 0.0024 0.0525 0.0455
Loa Loa (eye worm) hypothetical protein 0.0034 0.1302 0.1238
Entamoeba histolytica protein kinase domain containing protein 0.009 0.5489 1
Schistosoma mansoni tar DNA-binding protein 0.0064 0.3513 0.5281
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0024 0.0525 1
Leishmania major serine/threonine-protein kinase, putative,protein kinase, putative 0.009 0.5489 1
Brugia malayi RNA binding protein 0.0064 0.3513 0.3154
Entamoeba histolytica hypothetical protein 0.0036 0.145 0.1863
Echinococcus granulosus muscleblind protein 0.0151 1 1
Brugia malayi TAR-binding protein 0.0064 0.3513 0.3154
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.0073 0.5
Leishmania major endo/exonuclease Mre11, putative 0.0034 0.1302 0.1565
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.0525 1
Toxoplasma gondii Mre11 DNA-binding domain-containing protein 0.0034 0.1302 0.5
Brugia malayi Protein kinase domain containing protein 0.009 0.5489 0.524
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0036 0.145 0.017
Brugia malayi double-strand break repair protein mre-11 0.0034 0.1302 0.082
Schistosoma mansoni tar DNA-binding protein 0.0064 0.3513 0.5281
Loa Loa (eye worm) hypothetical protein 0.0024 0.0525 0.0455
Schistosoma mansoni transcription factor LCR-F1 0.0036 0.145 0.0354
Loa Loa (eye worm) hypothetical protein 0.0151 1 1
Loa Loa (eye worm) CMGC/DYRK/DYRK1 protein kinase 0.009 0.5489 0.5456
Echinococcus multilocularis muscleblind protein 0.0151 1 1
Schistosoma mansoni tar DNA-binding protein 0.0064 0.3513 0.5281

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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