Detailed information for compound 887740

Basic information

Technical information
  • TDR Targets ID: 887740
  • Name: 4-ethyl-N-(2-phenylsulfanylphenyl)benzenesulf onamide
  • MW: 369.5 | Formula: C20H19NO2S2
  • H donors: 1 H acceptors: 2 LogP: 5.31 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCc1ccc(cc1)S(=O)(=O)Nc1ccccc1Sc1ccccc1
  • InChi: 1S/C20H19NO2S2/c1-2-16-12-14-18(15-13-16)25(22,23)21-19-10-6-7-11-20(19)24-17-8-4-3-5-9-17/h3-15,21H,2H2,1H3
  • InChiKey: RQKDFQXIECHTQZ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 4-ethyl-N-[2-(phenylthio)phenyl]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
Echinococcus granulosus Nuclear hormone receptor HR96 0.0051 0.174 0.4095
Schistosoma mansoni nuclear hormone receptor 0.0108 0.425 1
Brugia malayi hypothetical protein 0.0057 0.2009 0.2302
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.003 0.0822 0.1935
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0108 0.425 0.4871
Brugia malayi orphan nuclear receptor NR2E1 0.0051 0.174 0.1994
Echinococcus multilocularis retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha 0.0051 0.174 0.4095
Loa Loa (eye worm) hypothetical protein 0.0057 0.2009 0.2302
Brugia malayi hypothetical protein 0.0051 0.174 0.1994
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0108 0.425 1
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0108 0.425 1
Trypanosoma cruzi hypothetical protein, conserved 0.0011 0 0.5
Brugia malayi nuclear hormone receptor family member odr-7 0.0051 0.174 0.1994
Loa Loa (eye worm) DR-78 0.0051 0.174 0.1994
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0108 0.425 0.425
Onchocerca volvulus 0.0024 0.055 0.055
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0108 0.425 0.4871
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0051 0.174 0.4095
Plasmodium vivax acyl-CoA synthetase, putative 0.0018 0.0284 0.3458
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0108 0.425 1
Trypanosoma brucei oxidoreductase-like protein 0.0011 0 0.5
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0242 0.4391
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0108 0.425 1
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0822 0.1935
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0108 0.425 0.4871
Brugia malayi AMP-binding enzyme family protein 0.0024 0.055 0.0631
Brugia malayi photoreceptor-specific nuclear receptor 0.0108 0.425 0.4871
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0018 0.0284 0.517
Loa Loa (eye worm) hypothetical protein 0.003 0.0822 0.0943
Loa Loa (eye worm) hypothetical protein 0.0018 0.0284 0.0326
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0011 0 0.5
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0822 0.1935
Brugia malayi steroid hormone receptor 0.0108 0.425 0.4871
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0029 0.0774 0.1821
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0057 0.2009 0.4727
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0108 0.425 1
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0108 0.425 0.4871
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.055 1
Echinococcus granulosus FTZ F1 alpha 0.0108 0.425 1
Brugia malayi nuclear receptor subfamily 1, group D, member 1, putative 0.0051 0.174 0.1994
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0108 0.425 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0108 0.425 0.4871
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0018 0.0284 0.517
Echinococcus multilocularis ecdysone induced protein 78C 0.0108 0.425 1
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.003 0.0822 0.1935
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0011 0 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0108 0.425 1
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0108 0.425 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.055 0.0631
Echinococcus multilocularis nuclear receptor subfamily 4 group A 0.0051 0.174 0.4095
Brugia malayi ecdysone receptor 0.0051 0.174 0.1994
Schistosoma mansoni steroid hormone receptor ad4bp 0.0108 0.425 1
Plasmodium falciparum acyl-CoA synthetase 0.0018 0.0284 1
Echinococcus granulosus histone lysine methyltransferase setb 0.003 0.0822 0.1935
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0108 0.425 0.4871
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0108 0.425 1
Loa Loa (eye worm) hypothetical protein 0.0024 0.055 0.0631
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0242 0.4391
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0108 0.425 1
Schistosoma mansoni thyroid hormone receptor 0.0108 0.425 1
Schistosoma mansoni zinc finger protein 0.0051 0.174 0.4095
Echinococcus multilocularis nuclear receptor subfamily 1 group D 0.0057 0.2009 0.4727
Loa Loa (eye worm) hypothetical protein 0.0024 0.055 0.0631
Schistosoma mansoni ecdysone-induced protein 78c (dr-78) 0.0057 0.2009 0.4727
Onchocerca volvulus Protein ultraspiracle homolog 0.0108 0.425 0.425
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0024 0.055 1
Brugia malayi nuclear receptor NHR-88 0.0108 0.425 0.4871
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0051 0.174 0.4095
Trypanosoma brucei short-chain dehydrogenase, putative 0.0011 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Brugia malayi ecdysteroid receptor 0.0108 0.425 0.4871
Schistosoma mansoni hepatocyte nuclear factor 4-alpha (hnf-4-alpha) 0.0051 0.174 0.4095
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0108 0.425 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.055 1
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0018 0.0284 0.5
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0108 0.425 0.4871
Loa Loa (eye worm) hypothetical protein 0.0057 0.2009 0.2302
Brugia malayi conserved hypotetical protein 0.0051 0.174 0.1994
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0108 0.425 0.4871
Onchocerca volvulus 0.0108 0.425 0.425
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0108 0.425 0.4871
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0108 0.425 0.4871
Brugia malayi tailless protein 0.0051 0.174 0.1994
Schistosoma mansoni retinoic acid receptor RXR 0.0108 0.425 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.055 1
Giardia lamblia Short-chain dehydrogenase, putative 0.0011 0 0.5
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0051 0.174 0.174
Echinococcus granulosus ecdysone induced protein 78C 0.0108 0.425 1
Loa Loa (eye worm) steroid hormone receptor 0.0108 0.425 0.4871
Schistosoma mansoni nuclear receptor 0.0051 0.174 0.4095
Giardia lamblia Reductase, putative 0.0011 0 0.5
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0011 0 0.5
Trypanosoma brucei beta-ketoacyl-ACP reductase 3, putative 0.0011 0 0.5
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0108 0.425 0.4871
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.003 0.0822 0.1935
Brugia malayi nuclear receptor RXR 0.0057 0.2009 0.2302
Brugia malayi nuclear receptor NHR-88 0.0051 0.174 0.1994
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Echinococcus granulosus nuclear receptor nhr 48 0.0051 0.174 0.4095
Schistosoma mansoni nuclear receptor 0.0051 0.174 0.4095
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0108 0.425 1
Loa Loa (eye worm) nuclear receptor NHR-67 0.0051 0.174 0.1994
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0011 0 0.5
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0051 0.174 0.4095
Trypanosoma brucei short-chain dehydrogenase, putative 0.0011 0 0.5
Trypanosoma brucei beta-D-hydroxybutyrate dehydrogenase 0.0011 0 0.5
Mycobacterium ulcerans hypothetical protein 0.0024 0.055 1
Echinococcus multilocularis thyroid hormone receptor alpha 0.0108 0.425 1
Echinococcus multilocularis nuclear receptor nhr 48 0.0051 0.174 0.4095
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.055 1
Loa Loa (eye worm) hypothetical protein 0.0108 0.425 0.4871
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.055 1
Trypanosoma cruzi 3-keto-dihydrosphingosine reductase 0.0011 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Trypanosoma brucei short-chain dehydrogenase, putative 0.0011 0 0.5
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0024 0.055 1
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0108 0.425 0.4871
Loa Loa (eye worm) nuclear hormone receptor 0.0051 0.174 0.1994
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0108 0.425 1
Trypanosoma cruzi short chain dehydrogenase, putative 0.0011 0 0.5
Onchocerca volvulus 0.0051 0.174 0.174
Trypanosoma cruzi hypothetical protein, conserved 0.0011 0 0.5
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0011 0 0.5
Brugia malayi Nuclear hormone receptor-like 1 0.0057 0.2009 0.2302
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0108 0.425 1
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0108 0.425 0.4871
Loa Loa (eye worm) hypothetical protein 0.0108 0.425 0.4871
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0108 0.425 0.4871
Echinococcus granulosus nuclear receptor subfamily 1 group D 0.0057 0.2009 0.4727
Leishmania major 4-coumarate:coa ligase-like protein 0.0024 0.055 1
Brugia malayi hypothetical protein 0.0051 0.174 0.1994
Onchocerca volvulus 0.003 0.0822 0.0822
Brugia malayi AMP-binding enzyme family protein 0.0024 0.055 0.0631
Trypanosoma cruzi beta-ketoacyl-ACP reductase 2, putative 0.0011 0 0.5
Trypanosoma cruzi 3-ketoacyl-CoA reductase, putative 0.0011 0 0.5
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.003 0.0822 1
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Brugia malayi Nuclear hormone receptor-like 1 0.0108 0.425 0.4871
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.055 1
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0242 0.4391
Trypanosoma cruzi hypothetical protein, conserved 0.0011 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0108 0.425 0.4871
Mycobacterium ulcerans acyl-CoA synthetase 0.0024 0.055 1
Brugia malayi AMP-binding enzyme family protein 0.0024 0.055 0.0631
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0108 0.425 1
Brugia malayi Nuclear hormone receptor-like 1 0.0057 0.2009 0.2302
Brugia malayi Nuclear hormone receptor E75 0.0051 0.174 0.1994
Plasmodium vivax SET domain protein, putative 0.003 0.0822 1
Loa Loa (eye worm) hypothetical protein 0.0057 0.2009 0.2302
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Loa Loa (eye worm) hypothetical protein 0.0057 0.2009 0.2302
Echinococcus granulosus Nuclear hormone receptor HR96 0.0051 0.174 0.4095
Echinococcus multilocularis FTZ F1 alpha 0.0108 0.425 1
Loa Loa (eye worm) hypothetical protein 0.0108 0.425 0.4871
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0024 0.055 1
Brugia malayi Nuclear hormone receptor E75 0.0051 0.174 0.1994
Loa Loa (eye worm) hypothetical protein 0.0018 0.0284 0.0326
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0108 0.425 0.4871
Loa Loa (eye worm) hypothetical protein 0.0108 0.425 0.4871
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Echinococcus granulosus thyroid hormone receptor alpha 0.0051 0.174 0.4095
Onchocerca volvulus 0.0018 0.0309 0.0309
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0108 0.425 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0011 0 0.5
Brugia malayi Steroid receptor seven-up type 2 0.0108 0.425 0.4871
Loa Loa (eye worm) hypothetical protein 0.0108 0.425 0.4871
Trypanosoma cruzi quinonoid dihydropteridine reductase, putative 0.0011 0 0.5
Trypanosoma brucei beta-ketoacyl-ACP reductase 2 0.0011 0 0.5
Wolbachia endosymbiont of Brugia malayi Short-chain alcohol dehydrogenase family enzyme 0.0011 0 0.5
Trypanosoma cruzi short chain dehydrogenase/reductase, putative 0.0011 0 0.5
Trypanosoma brucei 3-ketoacyl-CoA reductase, putative 0.0011 0 0.5
Onchocerca volvulus Bile acid receptor homolog 0.0108 0.425 0.425
Trypanosoma cruzi hypothetical protein, conserved 0.0011 0 0.5
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0024 0.055 1
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.003 0.0822 0.1935
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0011 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0108 0.425 0.4871
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0108 0.425 0.4871
Trypanosoma cruzi hypothetical protein, conserved 0.0011 0 0.5
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0108 0.425 0.4871
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0011 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0018 0.0284 0.0326
Schistosoma mansoni RAR-like nuclear receptor 0.0108 0.425 1
Brugia malayi Pre-SET motif family protein 0.003 0.0822 0.0943
Entamoeba histolytica acyl-coA synthetase, putative 0.0024 0.055 1
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0108 0.425 0.4871
Loa Loa (eye worm) nuclear hormone receptor-like 1 0.0057 0.2009 0.2302
Schistosoma mansoni nuclear hormone receptor 0.0051 0.174 0.4095
Onchocerca volvulus Nuclear receptor subfamily 6 group A member 1 homolog 0.0051 0.174 0.174
Onchocerca volvulus 0.0051 0.174 0.174
Loa Loa (eye worm) hypothetical protein 0.0018 0.0284 0.0326
Schistosoma mansoni thyroid hormone receptor 0.0108 0.425 1
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0211 0.8725 1
Trypanosoma brucei 3-keto-dihydrosphingosine reductase 0.0011 0 0.5
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0024 0.055 1
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0024 0.055 1
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Giardia lamblia Oxidoreductase, short chain dehydrogenase/reductase family 0.0011 0 0.5
Echinococcus multilocularis Nuclear hormone receptor HR96 0.0051 0.174 0.4095
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0051 0.174 0.4095
Trypanosoma cruzi hypothetical protein, conserved 0.0011 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0108 0.425 0.4871
Brugia malayi nuclear receptor NHR-67 0.0051 0.174 0.1994
Giardia lamblia Hypothetical protein 0.0011 0 0.5
Entamoeba histolytica acyl-CoA synthetase, putative 0.0024 0.055 1
Trichomonas vaginalis set domain proteins, putative 0.024 1 1
Trypanosoma cruzi NAD(P)-dependent oxidoreductase, putative 0.0011 0 0.5
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Loa Loa (eye worm) nuclear receptor nhr-7B 0.0051 0.174 0.1994
Trypanosoma cruzi short-chain dehydrogenase, putative 0.0011 0 0.5
Echinococcus granulosus nuclear receptor subfamily 4 group A 0.0051 0.174 0.4095
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0108 0.425 1
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Brugia malayi Pre-SET motif family protein 0.0211 0.8725 1
Schistosoma mansoni nuclear receptor nhr-48 0.0051 0.174 0.4095
Trypanosoma cruzi oxidoreductase-like protein, putative 0.0011 0 0.5
Brugia malayi nuclear hormone receptor 0.0051 0.174 0.1994
Brugia malayi hypothetical protein 0.0057 0.2009 0.2302
Schistosoma mansoni coup transcription factor 0.0108 0.425 1
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0024 0.055 1
Trypanosoma cruzi short chain dehydrogenase, putative 0.0011 0 0.5
Brugia malayi nuclear receptor RXR 0.0051 0.174 0.1994
Loa Loa (eye worm) hypothetical protein 0.0018 0.0284 0.0326
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0108 0.425 0.4871
Brugia malayi nuclear hormone receptor 0.0108 0.425 0.4871
Loa Loa (eye worm) hypothetical protein 0.0057 0.2009 0.2302
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0108 0.425 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0108 0.425 0.4871
Loa Loa (eye worm) hypothetical protein 0.0051 0.174 0.1994
Schistosoma mansoni nuclear hormone receptor 0.0051 0.174 0.4095
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0108 0.425 1
Trypanosoma brucei short-chain dehydrogenase, putative 0.0011 0 0.5
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0017 0.0242 0.4391
Brugia malayi nuclear hormone receptor family member nhr-6 0.0051 0.174 0.1994

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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