Detailed information for compound 688308

Basic information

Technical information
  • TDR Targets ID: 688308
  • Name: 4-chloro-N-[2-[4-(4-methoxyphenyl)piperazin-1 -yl]sulfonylethyl]benzenesulfonamide
  • MW: 473.994 | Formula: C19H24ClN3O5S2
  • H donors: 1 H acceptors: 4 LogP: 2.37 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccc(cc1)N1CCN(CC1)S(=O)(=O)CCNS(=O)(=O)c1ccc(cc1)Cl
  • InChi: 1S/C19H24ClN3O5S2/c1-28-18-6-4-17(5-7-18)22-11-13-23(14-12-22)29(24,25)15-10-21-30(26,27)19-8-2-16(20)3-9-19/h2-9,21H,10-15H2,1H3
  • InChiKey: PVASSLDLABSHNM-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-chloro-N-[2-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]ethyl]benzenesulfonamide

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
Brugia malayi hypothetical protein 0.0137 0.177 0.177
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0052 0.0269 0.009
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0052 0.0269 0.0269
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0052 0.0269 0.0687
Loa Loa (eye worm) hypothetical protein 0.0052 0.0269 0.009
Brugia malayi bZIP transcription factor family protein 0.0174 0.2436 0.2436
Loa Loa (eye worm) hypothetical protein 0.0052 0.0269 0.009
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0052 0.0269 0.0786
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0052 0.0269 0.0269
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0052 0.0269 0.009
Echinococcus multilocularis jun protein 0.0174 0.2436 0.7133
Schistosoma mansoni coup transcription factor 0.0052 0.0269 0.0687
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0052 0.0269 0.0687
Loa Loa (eye worm) hypothetical protein 0.0052 0.0269 0.009
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.018 0.0461
Brugia malayi nuclear receptor NHR-88 0.0052 0.0269 0.0269
Mycobacterium ulcerans aldehyde dehydrogenase 0.0063 0.0457 0.5
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0052 0.0269 0.0687
Loa Loa (eye worm) hypothetical protein 0.0052 0.0269 0.009
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0052 0.0269 0.0269
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0052 0.0269 0.0687
Brugia malayi nuclear hormone receptor 0.0052 0.0269 0.0269
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0052 0.0269 0.0687
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.023 0.3415 1
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0052 0.0269 0.0269
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0052 0.0269 0.0687
Loa Loa (eye worm) hypothetical protein 0.046 0.7514 0.7468
Onchocerca volvulus 0.0137 0.177 0.2072
Schistosoma mansoni thyroid hormone receptor 0.0052 0.0269 0.0687
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0052 0.0269 0.0786
Loa Loa (eye worm) hypothetical protein 0.017 0.2351 0.221
Loa Loa (eye worm) runx1 0.0058 0.0362 0.0185
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0052 0.0269 0.0687
Schistosoma mansoni RAR-like nuclear receptor 0.0052 0.0269 0.0687
Echinococcus multilocularis ecdysone induced protein 78C 0.0052 0.0269 0.0786
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0052 0.0269 0.0269
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0052 0.0269 0.0786
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0052 0.0269 0.0269
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.018 0.0528
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0052 0.0269 0.009
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0052 0.0269 0.0786
Echinococcus multilocularis FTZ F1 alpha 0.0052 0.0269 0.0786
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0052 0.0269 0.0269
Echinococcus granulosus Basic leucine zipper bZIP transcription factor 0.0174 0.2436 0.6233
Mycobacterium ulcerans aldehyde dehydrogenase 0.0063 0.0457 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.018 0.0461
Schistosoma mansoni steroid hormone receptor ad4bp 0.0052 0.0269 0.0687
Loa Loa (eye worm) hypothetical protein 0.0052 0.0269 0.009
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.018 0.0461
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0063 0.0457 0.5
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0052 0.0269 0.0269
Onchocerca volvulus 0.046 0.7514 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0052 0.0269 0.009
Brugia malayi Steroid receptor seven-up type 2 0.0052 0.0269 0.0269
Loa Loa (eye worm) hypothetical protein 0.0052 0.0269 0.009
Entamoeba histolytica hypothetical protein 0.0037 0 0.5
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0063 0.0457 0.1338
Brugia malayi Nuclear hormone receptor-like 1 0.0052 0.0269 0.0269
Loa Loa (eye worm) steroid hormone receptor 0.0052 0.0269 0.009
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0052 0.0269 0.009
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0052 0.0269 0.0269
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0052 0.0269 0.0687
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0052 0.0269 0.0269
Loa Loa (eye worm) hypothetical protein 0.0052 0.0269 0.009
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0052 0.0269 0.0687
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0052 0.0269 0.0269
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0052 0.0269 0.0687
Echinococcus granulosus jun protein 0.0174 0.2436 0.6233
Schistosoma mansoni jun-related protein 0.0142 0.1855 0.4747
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0052 0.0269 0.0786
Brugia malayi hypothetical protein 0.046 0.7514 0.7514
Echinococcus granulosus ecdysone induced protein 78C 0.0052 0.0269 0.0687
Echinococcus granulosus FTZ F1 alpha 0.0052 0.0269 0.0687
Loa Loa (eye worm) hypothetical protein 0.06 1 1
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0257 0.3908 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0048 0.018 0.018
Entamoeba histolytica hypothetical protein 0.0037 0 0.5
Brugia malayi photoreceptor-specific nuclear receptor 0.0052 0.0269 0.0269
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0048 0.018 0.0461
Schistosoma mansoni aldehyde dehydrogenase 0.0063 0.0457 0.1169
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0048 0.018 0.0528
Schistosoma mansoni aldehyde dehydrogenase 0.0063 0.0457 0.1169
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0052 0.0269 0.0687
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0052 0.0269 0.009
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0052 0.0269 0.0269
Schistosoma mansoni retinoic acid receptor RXR 0.0257 0.3908 1
Brugia malayi ecdysteroid receptor 0.0052 0.0269 0.0269
Mycobacterium ulcerans aldehyde dehydrogenase 0.0063 0.0457 0.5
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0063 0.0457 0.5
Entamoeba histolytica hypothetical protein 0.0037 0 0.5
Brugia malayi steroid hormone receptor 0.0052 0.0269 0.0269
Loa Loa (eye worm) hypothetical protein 0.046 0.7514 0.7468
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0052 0.0269 0.0786
Schistosoma mansoni thyroid hormone receptor 0.0052 0.0269 0.0687
Schistosoma mansoni lozenge 0.0058 0.0362 0.0925
Toxoplasma gondii aldehyde dehydrogenase 0.0063 0.0457 0.5
Echinococcus multilocularis Protein lozenge 0.0058 0.0362 0.1059
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0052 0.0269 0.009
Schistosoma mansoni hypothetical protein 0.0142 0.1855 0.4747
Loa Loa (eye worm) hypothetical protein 0.0052 0.0269 0.009
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription factor 0.0174 0.2436 0.7133
Entamoeba histolytica hypothetical protein 0.0037 0 0.5
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0052 0.0269 0.0687
Echinococcus multilocularis thyroid hormone receptor alpha 0.0052 0.0269 0.0786
Schistosoma mansoni nuclear hormone receptor 0.0052 0.0269 0.0687
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0063 0.0457 0.1169
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0048 0.018 0.0461
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0052 0.0269 0.0269

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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