Detailed information for compound 716964

Basic information

Technical information
  • TDR Targets ID: 716964
  • Name: 4-chloro-2,5-dimethoxy-N-[2-(trifluoromethyl) phenyl]benzenesulfonamide
  • MW: 395.781 | Formula: C15H13ClF3NO4S
  • H donors: 1 H acceptors: 2 LogP: 3.9 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1cc(Cl)c(cc1S(=O)(=O)Nc1ccccc1C(F)(F)F)OC
  • InChi: 1S/C15H13ClF3NO4S/c1-23-12-8-14(13(24-2)7-10(12)16)25(21,22)20-11-6-4-3-5-9(11)15(17,18)19/h3-8,20H,1-2H3
  • InChiKey: KETWMFLRCYJQPI-UHFFFAOYSA-N  

Network

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Synonyms

  • T5968808
  • ZINC06700675

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 0.003 0.0453 0.1519
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0015 0.0058 0.0069
Echinococcus granulosus jumonji domain containing protein 0.0027 0.0378 0.1417
Trichomonas vaginalis rotamase, putative 0.0022 0.0237 0.0237
Schistosoma mansoni rab6-interacting 0.0013 0.0007 0.0009
Plasmodium falciparum phd finger protein, putative 0.0019 0.0175 1
Loa Loa (eye worm) jmjC domain-containing protein 0.004 0.0727 0.2438
Echinococcus granulosus lysine specific demethylase 5A 0.0025 0.0318 0.1192
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0041 0.0737 0.1004
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0079 0.1754 0.6569
Leishmania major mitochondrial DNA polymerase beta-PAK, putative 0.0136 0.3292 0.4486
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0059 0.008
Loa Loa (eye worm) hypothetical protein 0.0047 0.0915 0.3065
Schistosoma mansoni bcl-2 homologous antagonist/killer (bak) 0.0055 0.113 0.1354
Loa Loa (eye worm) PHD-finger family protein 0.0019 0.0175 0.0587
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0059 0.008
Brugia malayi jmjC domain containing protein 0.0025 0.0318 0.1067
Loa Loa (eye worm) jmjC domain-containing protein 0.0025 0.0318 0.1067
Mycobacterium tuberculosis Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase) 0.0086 0.1958 0.5287
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.004 0.0719 0.2691
Brugia malayi isocitrate dehydrogenase 0.0015 0.0059 0.0197
Echinococcus multilocularis zinc finger protein 0.0013 0.0005 0.0018
Schistosoma mansoni hypothetical protein 0.0013 0.0007 0.0009
Loa Loa (eye worm) hypothetical protein 0.0026 0.0339 0.1137
Echinococcus granulosus lipoxygenase domain containing protein 0.0013 0.0007 0.0028
Echinococcus granulosus RUN 0.0013 0.0007 0.0028
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0079 0.1754 0.6569
Schistosoma mansoni transcription factor LCR-F1 0.0034 0.0572 0.0686
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0288 0.7339 1
Toxoplasma gondii ImpB/MucB/SamB family protein 0.0021 0.0216 0.0993
Schistosoma mansoni zinc finger protein 0.0013 0.0005 0.0006
Loa Loa (eye worm) hypothetical protein 0.0028 0.0415 0.1392
Loa Loa (eye worm) hypothetical protein 0.0055 0.113 0.3786
Echinococcus granulosus microsomal glutathione S transferase 3 0.0075 0.1647 0.6167
Echinococcus multilocularis microsomal glutathione S transferase 3 0.0075 0.1647 0.6167
Trypanosoma cruzi mitochondrial DNA polymerase beta, putative 0.0288 0.7339 1
Trypanosoma brucei DNA polymerase beta thumb, putative 0.0041 0.0737 0.1004
Echinococcus multilocularis isocitrate dehydrogenase 0.0015 0.0059 0.022
Onchocerca volvulus 0.0125 0.2983 1
Loa Loa (eye worm) isocitrate dehydrogenase 0.0015 0.0059 0.0197
Schistosoma mansoni rotamase 0.0022 0.0251 0.0301
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0022 0.0237 0.0323
Schistosoma mansoni polycystin 1-related 0.0013 0.0007 0.0009
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0125 0.2983 0.2983
Brugia malayi Bromodomain containing protein 0.005 0.0991 0.332
Toxoplasma gondii hypothetical protein 0.0046 0.0896 0.5271
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0125 0.2983 0.2983
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0015 0.0059 0.008
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0024 0.0296 0.1108
Schistosoma mansoni lipoxygenase 0.0055 0.1123 0.1346
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0019 0.0175 0.021
Trypanosoma cruzi DNA polymerase eta, putative 0.0021 0.0216 0.0295
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.0022 0.0237 0.0323
Schistosoma mansoni hypothetical protein 0.0019 0.0175 0.021
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0024 0.0296 0.1108
Echinococcus multilocularis lipoxygenase domain containing protein 0.0013 0.0007 0.0028
Brugia malayi Doublecortin family protein 0.0013 0.0007 0.0025
Loa Loa (eye worm) hypothetical protein 0.0033 0.0546 0.1829
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0041 0.0737 0.1004
Trichomonas vaginalis conserved hypothetical protein 0.0022 0.0251 0.0251
Echinococcus granulosus zinc finger protein 0.0013 0.0005 0.0018
Brugia malayi Low molecular weight phosphotyrosine protein phosphatase containing protein 0.0125 0.2983 1
Toxoplasma gondii MAPEG family protein 0.0075 0.1647 1
Schistosoma mansoni jumonji domain containing protein 0.0051 0.1006 0.1206
Toxoplasma gondii PHD-finger domain-containing protein 0.0019 0.0175 0.0734
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0038 0.0682 0.0682
Entamoeba histolytica hypothetical protein 0.0034 0.0572 0.0572
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0034 0.0572 0.2142
Entamoeba histolytica hypothetical protein 0.0034 0.0572 0.0572
Brugia malayi jmjC domain containing protein 0.0064 0.1355 0.4542
Echinococcus multilocularis lysine specific demethylase 5A 0.0024 0.0284 0.1065
Entamoeba histolytica hypothetical protein 0.0034 0.0572 0.0572
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.0022 0.0237 0.0323
Echinococcus multilocularis Bcl 2 ous antagonist:killer 0.0055 0.113 0.423
Schistosoma mansoni membrane associated proteins in eicosanoid and glutathione metabolism family member 0.0326 0.8341 1
Brugia malayi ImpB/MucB/SamB family protein 0.003 0.0453 0.1519
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0125 0.2983 0.2983
Onchocerca volvulus Alhambra homolog 0.0019 0.0175 0.0564
Schistosoma mansoni DNA polymerase eta 0.003 0.0453 0.0543
Mycobacterium tuberculosis Conserved hypothetical protein 0.0152 0.3703 1
Schistosoma mansoni hypothetical protein 0.0055 0.113 0.1354
Echinococcus multilocularis dna polymerase eta 0.003 0.0453 0.1697
Echinococcus multilocularis jumonji domain containing protein 0.0027 0.0378 0.1417
Echinococcus granulosus peregrin 0.0021 0.0217 0.0814
Echinococcus multilocularis peregrin 0.0021 0.0217 0.0814
Loa Loa (eye worm) apoptosis regulator protein 0.0055 0.113 0.3786
Loa Loa (eye worm) hypothetical protein 0.0013 0.0007 0.0025
Leishmania major DNA polymerase eta, putative 0.003 0.0453 0.0617
Echinococcus multilocularis Polycystic kidney disease protein 0.0013 0.0007 0.0028
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0015 0.0059 0.008
Loa Loa (eye worm) phosphotyrosine protein phosphatase 0.0125 0.2983 1
Brugia malayi hypothetical protein 0.0013 0.0007 0.0025
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0015 0.0059 0.3051
Loa Loa (eye worm) hypothetical protein 0.0027 0.0381 0.1278
Brugia malayi Apoptosis regulator proteins, Bcl-2 family protein 0.0055 0.113 0.3786
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0136 0.3292 0.4486
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0125 0.2983 0.2983
Trypanosoma cruzi mitochondrial DNA polymerase beta-PAK, putative 0.0049 0.0973 0.1326
Echinococcus granulosus dna polymerase eta 0.003 0.0453 0.1697
Schistosoma mansoni hypothetical protein 0.0055 0.113 0.1354
Schistosoma mansoni jumonji/arid domain-containing protein 0.0025 0.0318 0.0382
Echinococcus granulosus lipoxygenase domain containing protein 0.0013 0.0007 0.0028
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0059 0.022
Schistosoma mansoni lipoxygenase 0.0079 0.1754 0.2103
Echinococcus multilocularis RUN 0.0013 0.0007 0.0028
Brugia malayi hypothetical protein 0.0034 0.0572 0.1917
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0015 0.0059 0.0158
Schistosoma mansoni apoptosis regulator bax 0.0055 0.113 0.1354
Echinococcus multilocularis lipoxygenase domain containing protein 0.0013 0.0007 0.0028
Leishmania major hypothetical protein, conserved 0.0038 0.0682 0.093
Brugia malayi Bromodomain containing protein 0.0021 0.0217 0.0729
Schistosoma mansoni hypothetical protein 0.0014 0.0024 0.0028
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.0022 0.0251 0.0841
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0059 0.022
Trichomonas vaginalis low molecular weight protein-tyrosine-phosphatase, putative 0.0125 0.2983 0.2983
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0064 0.1355 0.5074
Plasmodium vivax hypothetical protein, conserved 0.0019 0.0175 1
Trypanosoma cruzi DNA polymerase eta, putative 0.003 0.0453 0.0617
Schistosoma mansoni hypothetical protein 0.0034 0.0572 0.0686
Brugia malayi hypothetical protein 0.0013 0.0007 0.0025
Schistosoma mansoni loxhd1 0.0013 0.0007 0.0009
Echinococcus granulosus fetal alzheimer antigen falz 0.0015 0.0058 0.0216
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0125 0.2983 0.2983
Toxoplasma gondii peptidylprolyl isomerase 0.0022 0.0237 0.1122
Echinococcus granulosus Polycystic kidney disease protein 0.0013 0.0007 0.0028
Schistosoma mansoni hypothetical protein 0.0113 0.267 0.3201
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0034 0.0572 0.2142
Trypanosoma brucei low molecular weight protein tyrosine phosphatase, putative 0.0038 0.0682 0.093
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0038 0.0682 0.0682
Echinococcus granulosus EGFP:Bcl2 fusion protein 0.0055 0.113 0.423
Echinococcus granulosus geminin 0.0113 0.267 1
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0015 0.0059 0.3051
Trichomonas vaginalis low molecular weight protein tyrosine phosphatase, putative 0.0125 0.2983 0.2983
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0015 0.0059 0.007
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.004 0.0719 0.2691
Loa Loa (eye worm) hypothetical protein 0.0013 0.0007 0.0025
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0015 0.0059 0.022
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0682 0.093
Brugia malayi Bromodomain containing protein 0.0026 0.0338 0.1133
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0015 0.0059 0.022
Schistosoma mansoni jumonji/arid domain-containing protein 0.0025 0.0318 0.0382
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0125 0.2983 0.2983
Trypanosoma cruzi DNA polymerase beta thumb, putative 0.0041 0.0737 0.1004
Brugia malayi PHD-finger family protein 0.0019 0.0175 0.0587
Loa Loa (eye worm) doublecortin family protein 0.0013 0.0007 0.0025
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0015 0.0058 0.0216
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.0022 0.0237 0.0237
Schistosoma mansoni hypothetical protein 0.0113 0.267 0.3201
Trypanosoma cruzi hypothetical protein, conserved 0.0038 0.0682 0.093
Echinococcus granulosus expressed protein 0.0022 0.0251 0.0939
Giardia lamblia Low molecular weight protein-tyrosine-phosphatase 0.0125 0.2983 1
Trichomonas vaginalis rotamase, putative 0.0022 0.0251 0.0251
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0015 0.0059 0.008
Mycobacterium ulcerans hypothetical protein 0.0152 0.3703 1
Echinococcus granulosus Bcl 2 ous antagonist:killer 0.0055 0.113 0.423
Schistosoma mansoni rab6-interacting 0.0013 0.0007 0.0009
Trypanosoma brucei DNA polymerase eta, putative 0.003 0.0453 0.0617
Echinococcus multilocularis PHD finger protein rhinoceros 0.0019 0.0175 0.0656
Echinococcus multilocularis geminin 0.0113 0.267 1
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0064 0.1355 0.5074
Toxoplasma gondii PHD-finger domain-containing protein 0.0019 0.0175 0.0734
Entamoeba histolytica hypothetical protein 0.0034 0.0572 0.0572
Trypanosoma brucei mitochondrial DNA polymerase beta-PAK 0.0136 0.3292 0.4486
Leishmania major DNA polymerase eta, putative 0.0021 0.0216 0.0295
Giardia lamblia PHD finger protein 15 0.0019 0.0175 0.0587
Loa Loa (eye worm) hypothetical protein 0.0019 0.0175 0.0587
Echinococcus multilocularis EGFP:Bcl2 fusion protein 0.0055 0.113 0.423
Loa Loa (eye worm) PHD-finger family protein 0.0014 0.0024 0.008
Trichomonas vaginalis pps1 dual specificty phosphatase, putative 0.0388 1 1
Leishmania major mitochondrial DNA polymerase beta 0.0288 0.7339 1
Schistosoma mansoni hypothetical protein 0.0055 0.113 0.1354
Trypanosoma brucei mitochondrial DNA polymerase beta 0.0288 0.7339 1
Echinococcus multilocularis expressed protein 0.0022 0.0251 0.0939
Echinococcus granulosus PHD finger protein rhinoceros 0.0019 0.0175 0.0656
Mycobacterium ulcerans phosphotyrosine protein phosphatase PtpA 0.0125 0.2983 0.8056
Schistosoma mansoni microsomal glutathione s-transferase 0.0075 0.1647 0.1974
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0022 0.0237 0.0323
Brugia malayi Isocitrate dehydrogenase 0.0015 0.0059 0.0197
Schistosoma mansoni bromodomain containing protein 0.0042 0.0782 0.0938
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0015 0.0059 0.022
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.0022 0.0251 0.0841
Brugia malayi PHD-finger family protein 0.0017 0.01 0.0335

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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