Detailed information for compound 710761

Basic information

Technical information
  • TDR Targets ID: 710761
  • Name: N-(3-chloro-2-methylphenyl)-4-[(4-methylsulfa nylphenyl)sulfonylamino]benzenesulfonamide
  • MW: 483.024 | Formula: C20H19ClN2O4S3
  • H donors: 2 H acceptors: 4 LogP: 4.47 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CSc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)S(=O)(=O)Nc1cccc(c1C)Cl
  • InChi: 1S/C20H19ClN2O4S3/c1-14-19(21)4-3-5-20(14)23-30(26,27)17-10-6-15(7-11-17)22-29(24,25)18-12-8-16(28-2)9-13-18/h3-13,22-23H,1-2H3
  • InChiKey: UPFNSHUHZIDBQJ-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • N-(3-chloro-2-methyl-phenyl)-4-[(4-methylsulfanylphenyl)sulfonylamino]benzenesulfonamide
  • N-(3-chloro-2-methylphenyl)-4-[[4-(methylthio)phenyl]sulfonylamino]benzenesulfonamide
  • N-(3-chloro-2-methyl-phenyl)-4-[[4-(methylthio)phenyl]sulfonylamino]benzenesulfonamide
  • ZINC02882267

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
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0089 0.0921 0.0819
Loa Loa (eye worm) hypothetical protein 0.0039 0.0226 0.0224
Schistosoma mansoni nuclear receptor 2DBD-gamma 0.0039 0.0226 0.0452
Brugia malayi nuclear hormone receptor 0.0039 0.0226 0.0365
Brugia malayi acetyltransferase, GNAT family protein 0.0152 0.1803 0.448
Onchocerca volvulus 0.0151 0.1785 1
Echinococcus multilocularis Nuclear hormone receptor family member nhr 41 0.0039 0.0226 0.0226
Brugia malayi Nuclear hormone receptor family member nhr-3 0.0039 0.0226 0.0365
Loa Loa (eye worm) nuclear hormone receptor family member nhr-1 0.0039 0.0226 0.0224
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0099 0.1061 0.0976
Schistosoma mansoni nuclear hormone receptor nor-1/nor-2 0.0039 0.0226 0.0452
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.0195 0.039
Mycobacterium ulcerans arylamine N-acetyltransferase Nat 0.067 0.9064 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0039 0.0226 0.0365
Schistosoma mansoni RAR-like nuclear receptor 0.0039 0.0226 0.0452
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0089 0.0921 0.0819
Onchocerca volvulus Bile acid receptor homolog 0.0039 0.0226 0.0195
Echinococcus multilocularis beta LACTamase domain containing family member 0.0037 0.0195 0.0195
Loa Loa (eye worm) hypothetical protein 0.0039 0.0226 0.0224
Plasmodium falciparum ataxin-2 like protein, putative 0.0077 0.0753 1
Schistosoma mansoni photoreceptor-specific nuclear receptor related 0.0039 0.0226 0.0452
Schistosoma mansoni hypothetical protein 0.0033 0.0141 0.0282
Mycobacterium ulcerans glutaminase 0.0282 0.3625 0.3868
Loa Loa (eye worm) hypothetical protein 0.0303 0.392 1
Schistosoma mansoni nuclear hormone receptor superfamily protein-related 0.0379 0.4992 1
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0037 0.0194 0.0425
Trypanosoma cruzi PAB1-binding protein , putative 0.0077 0.0753 1
Echinococcus granulosus FTZ F1 alpha 0.0039 0.0226 0.0495
Loa Loa (eye worm) hypothetical protein 0.0151 0.1785 0.4351
Schistosoma mansoni retinoic acid receptor RXR 0.0039 0.0226 0.0452
Echinococcus multilocularis Ataxin 2, N terminal,domain containing protein 0.0035 0.0158 0.0158
Loa Loa (eye worm) nuclear Hormone Receptor family member 0.0039 0.0226 0.0224
Loa Loa (eye worm) acetyltransferase 0.0152 0.1803 0.4399
Schistosoma mansoni zinc finger protein 0.0024 0.0008 0.0017
Brugia malayi glutaminase DH11.1 0.0282 0.3625 0.9232
Brugia malayi latrophilin 2 splice variant baaae 0.0033 0.0141 0.0144
Loa Loa (eye worm) hypothetical protein 0.0051 0.0389 0.0657
Plasmodium falciparum histone acetyltransferase GCN5 0.004 0.0239 0.0338
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0049 0.0357 0.0707
Loa Loa (eye worm) hypothetical protein 0.0037 0.0195 0.0142
Echinococcus multilocularis hepatocyte nuclear factor 4 alpha 0.0039 0.0226 0.0226
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0039 0.0226 0.0226
Schistosoma mansoni retinoid-x-receptor (RXR) 0.0039 0.0226 0.0452
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0039 0.0226 0.0495
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0039 0.0226 0.0365
Trypanosoma cruzi PAB1-binding protein , putative 0.0077 0.0753 1
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0089 0.0921 0.0819
Brugia malayi Nuclear hormone receptor family member nhr-14 0.0039 0.0226 0.0365
Echinococcus multilocularis muscleblind protein 0.0303 0.392 0.392
Echinococcus multilocularis zinc finger protein 0.0024 0.0008 0.0008
Echinococcus multilocularis COUP TF:Svp nuclear hormone receptor 0.0039 0.0226 0.0226
Loa Loa (eye worm) hypothetical protein 0.0048 0.0342 0.0532
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0037 0.0195 0.0284
Loa Loa (eye worm) thioredoxin reductase 0.0039 0.0221 0.0212
Schistosoma mansoni Tr4/Tr2 (homologue) 0.0039 0.0226 0.0452
Brugia malayi hypothetical protein 0.0037 0.0194 0.0283
Brugia malayi hypothetical protein 0.0151 0.1785 0.4432
Toxoplasma gondii histone lysine acetyltransferase GCN5-B 0.0046 0.0324 0.2328
Schistosoma mansoni glutaminase 0.0282 0.3625 0.7263
Brugia malayi beta-lactamase family protein 0.0037 0.0195 0.0284
Giardia lamblia Histone acetyltransferase GCN5 0.004 0.0239 0.5
Trypanosoma brucei PAB1-binding protein , putative 0.0077 0.0753 1
Echinococcus granulosus histone acetyltransferase KAT2B 0.0145 0.171 0.3752
Loa Loa (eye worm) hypothetical protein 0.0037 0.0195 0.0142
Echinococcus multilocularis geminin 0.034 0.4444 0.4444
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0194 0.0194
Echinococcus granulosus Nuclear hormone receptor family member nhr 41 0.0039 0.0226 0.0495
Brugia malayi glutathione reductase 0.0039 0.0221 0.0353
Brugia malayi ecdysteroid receptor 0.0039 0.0226 0.0365
Loa Loa (eye worm) hypothetical protein 0.0037 0.0195 0.0142
Loa Loa (eye worm) hypothetical protein 0.0039 0.0226 0.0224
Trichomonas vaginalis cat eye syndrome critical region protein 2, cscr2, putative 0.0046 0.0324 0.0379
Onchocerca volvulus Steroid hormone receptor family member cnr14 homolog 0.0039 0.0226 0.0195
Loa Loa (eye worm) hypothetical protein 0.0049 0.0357 0.0572
Echinococcus multilocularis tumor protein p63 0.0349 0.4558 0.4558
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0039 0.0226 0.0365
Toxoplasma gondii thioredoxin reductase 0.0039 0.0221 0.0472
Schistosoma mansoni hypothetical protein 0.0035 0.0158 0.0316
Loa Loa (eye worm) hypothetical protein 0.0046 0.0314 0.0459
Brugia malayi Bromodomain containing protein 0.0081 0.081 0.1888
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0194 0.0389
Echinococcus granulosus COUP TF:Svp nuclear hormone receptor 0.0039 0.0226 0.0495
Schistosoma mansoni FTZ-F1 nuclear receptor-like protein 0.0039 0.0226 0.0452
Echinococcus multilocularis muscleblind protein 1 0.0303 0.392 0.392
Brugia malayi beta-lactamase 0.0037 0.0195 0.0284
Echinococcus multilocularis gcn5proteinral control of amino acid synthesis 0.0152 0.1803 0.1803
Toxoplasma gondii histone lysine acetyltransferase GCN5-A 0.0046 0.0324 0.2328
Echinococcus multilocularis thyroid hormone receptor alpha 0.0039 0.0226 0.0226
Plasmodium vivax glutathione reductase, putative 0.0039 0.0221 0.0472
Loa Loa (eye worm) hypothetical protein 0.0039 0.0226 0.0224
Loa Loa (eye worm) glutathione reductase 0.0039 0.0221 0.0212
Leishmania major hypothetical protein, conserved 0.0077 0.0753 1
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0099 0.1061 0.0976
Echinococcus granulosus thioredoxin glutathione reductase 0.004 0.0228 0.0501
Mycobacterium tuberculosis Probable oxidoreductase 0.0099 0.1061 0.0976
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0049 0.0357 0.0572
Echinococcus granulosus beta LACTamase domain containing family member 0.0037 0.0195 0.0427
Brugia malayi Bromodomain containing protein 0.0043 0.0279 0.0505
Onchocerca volvulus 0.0051 0.0389 0.1223
Echinococcus granulosus histone acetyltransferase KAT2B 0.0046 0.0324 0.0712
Loa Loa (eye worm) hypothetical protein 0.0039 0.0226 0.0224
Loa Loa (eye worm) hypothetical protein 0.0303 0.392 1
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0099 0.1061 1
Loa Loa (eye worm) nuclear hormone receptor family member nhr-40 0.0039 0.0226 0.0224
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0037 0.0194 0.0194
Brugia malayi Muscleblind-like protein 0.0303 0.392 1
Echinococcus granulosus ecdysone induced protein 78C 0.0039 0.0226 0.0495
Brugia malayi Thioredoxin reductase 0.0039 0.0221 0.0353
Loa Loa (eye worm) transcription factor SMAD2 0.024 0.3035 0.7657
Schistosoma mansoni hypothetical protein 0.034 0.4444 0.8902
Onchocerca volvulus Protein ultraspiracle homolog 0.0039 0.0226 0.0195
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.0195 0.039
Schistosoma mansoni cellular tumor antigen P53 0.0051 0.0389 0.0779
Loa Loa (eye worm) nuclear hormone receptor family member nhr-49 0.0039 0.0226 0.0224
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0037 0.0195 0.0142
Brugia malayi beta-lactamase family protein 0.0037 0.0195 0.0284
Echinococcus granulosus muscleblind protein 0.0303 0.392 0.86
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0065 0.0588 0.1291
Echinococcus granulosus hepatocyte nuclear factor 4 alpha 0.0039 0.0226 0.0495
Brugia malayi Calcitonin receptor-like protein seb-1 0.0049 0.0357 0.0707
Mycobacterium tuberculosis Probable dehydrogenase 0.0089 0.0921 0.0819
Brugia malayi Nuclear hormone receptor-like 1 0.0039 0.0226 0.0365
Brugia malayi Nuclear hormone receptor family member nhr-41 0.0039 0.0226 0.0365
Loa Loa (eye worm) hypothetical protein 0.0037 0.0195 0.0142
Echinococcus granulosus geminin 0.034 0.4444 0.9749
Schistosoma mansoni steroid hormone receptor ad4bp 0.0039 0.0226 0.0452
Schistosoma mansoni nuclear hormone receptor 0.0039 0.0226 0.0452
Schistosoma mansoni hypothetical protein 0.0037 0.0194 0.0389
Schistosoma mansoni thyroid hormone receptor 0.0039 0.0226 0.0452
Echinococcus multilocularis FTZ F1 nuclear receptor protein 0.0039 0.0226 0.0226
Echinococcus granulosus FTZ F1 nuclear receptor protein 0.0039 0.0226 0.0495
Echinococcus multilocularis FTZ F1 alpha 0.0039 0.0226 0.0226
Loa Loa (eye worm) nuclear hormone receptor family member nhr-41 0.0039 0.0226 0.0224
Loa Loa (eye worm) nuclear hormone receptor family member nhr-14 0.0039 0.0226 0.0224
Plasmodium vivax histone acetyltransferase GCN5, putative 0.0046 0.0324 0.2328
Trypanosoma brucei trypanothione reductase 0.0039 0.0221 0.0472
Brugia malayi hypothetical protein 0.0077 0.0753 0.174
Loa Loa (eye worm) beta-lactamase 0.0037 0.0195 0.0142
Plasmodium vivax thioredoxin reductase, putative 0.0039 0.0221 0.0472
Echinococcus granulosus retinoic acid receptor rxr beta a 0.0039 0.0226 0.0495
Trichomonas vaginalis bromodomain-containing protein, putative 0.0046 0.0324 0.0379
Brugia malayi MH2 domain containing protein 0.024 0.3035 0.7691
Loa Loa (eye worm) glutaminase 2 0.0282 0.3625 0.922
Brugia malayi Steroid receptor seven-up type 2 0.0039 0.0226 0.0365
Brugia malayi Nuclear hormone receptor family member nhr-1 0.0039 0.0226 0.0365
Brugia malayi hypothetical protein 0.005 0.037 0.0743
Brugia malayi Nuclear hormone receptor family member nhr-25 0.0039 0.0226 0.0365
Echinococcus granulosus nuclear receptor 2DBD gamma 0.0039 0.0226 0.0495
Brugia malayi photoreceptor-specific nuclear receptor 0.0039 0.0226 0.0365
Loa Loa (eye worm) hypothetical protein 0.0039 0.0226 0.0224
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0065 0.0588 0.0588
Leishmania major trypanothione reductase 0.0039 0.0221 0.0472
Brugia malayi Nuclear hormone receptor family member nhr-40 0.0039 0.0226 0.0365
Schistosoma mansoni thyroid hormone receptor 0.0039 0.0226 0.0452
Mycobacterium tuberculosis Probable reductase 0.0089 0.0921 0.0819
Echinococcus granulosus tumor protein p63 0.0349 0.4558 1
Loa Loa (eye worm) hypothetical protein 0.0039 0.0226 0.0224
Toxoplasma gondii LsmAD domain-containing protein 0.0077 0.0753 1
Schistosoma mansoni hypothetical protein 0.034 0.4444 0.8902
Brugia malayi steroid hormone receptor 0.0039 0.0226 0.0365
Echinococcus multilocularis ecdysone induced protein 78C 0.0039 0.0226 0.0226
Echinococcus granulosus Ataxin 2 N terminaldomain containing protein 0.0035 0.0158 0.0346
Loa Loa (eye worm) nuclear hormone receptor family member nhr-31 0.0039 0.0226 0.0224
Echinococcus multilocularis nuclear receptor 2DBD gamma 0.0039 0.0226 0.0226
Schistosoma mansoni coup transcription factor 0.0039 0.0226 0.0452
Loa Loa (eye worm) MH2 domain-containing protein 0.024 0.3035 0.7657
Loa Loa (eye worm) hypothetical protein 0.0037 0.0195 0.0142
Schistosoma mansoni bromodomain containing protein 0.0069 0.064 0.1282
Mycobacterium tuberculosis Arylamine N-acetyltransferase Nat (arylamine acetylase) 0.067 0.9064 1
Brugia malayi nuclear receptor NHR-88 0.0039 0.0226 0.0365
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0194 0.0426
Trichomonas vaginalis glutaminase, putative 0.0282 0.3625 1
Brugia malayi Nuclear hormone receptor family member nhr-31 0.0039 0.0226 0.0365
Loa Loa (eye worm) hypothetical protein 0.0077 0.0753 0.1619
Echinococcus multilocularis thioredoxin glutathione reductase 0.004 0.0228 0.0228
Entamoeba histolytica acetyltransferase, GNAT family 0.004 0.0239 1
Loa Loa (eye worm) steroid hormone receptor 0.0039 0.0226 0.0224
Schistosoma mansoni gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2 0.0152 0.1803 0.3613
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0237 0.2999 0.3162
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0089 0.0921 0.8393
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0039 0.0221 0.003
Onchocerca volvulus 0.0039 0.0226 0.0195
Plasmodium falciparum ataxin-2 like protein, putative 0.0077 0.0753 1
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0089 0.0921 0.0819
Loa Loa (eye worm) hypothetical protein 0.0037 0.0195 0.0142
Loa Loa (eye worm) glutaminase 0.0282 0.3625 0.922
Loa Loa (eye worm) hypothetical protein 0.004 0.0229 0.0233
Brugia malayi Nuclear hormone receptor family member nhr-49 0.0039 0.0226 0.0365
Trypanosoma cruzi trypanothione reductase, putative 0.0039 0.0221 0.0472
Loa Loa (eye worm) hypothetical protein 0.0039 0.0226 0.0224
Plasmodium vivax ataxin-2 like protein, putative 0.0077 0.0753 1
Brugia malayi Nuclear hormone receptor family member nhr-19 0.0039 0.0226 0.0365
Loa Loa (eye worm) hypothetical protein 0.0073 0.0696 0.147
Brugia malayi Ligand-binding domain of nuclear hormone receptor family protein 0.0039 0.0226 0.0365
Echinococcus granulosus zinc finger protein 0.0024 0.0008 0.0019

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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