Detailed information for compound 895497

Basic information

Technical information
  • TDR Targets ID: 895497
  • Name: 4-(4-chlorophenyl)sulfonyl-2-ethylsulfonyl-N- [(2-methoxyphenyl)methyl]-1,3-thiazol-5-amine
  • MW: 487.013 | Formula: C19H19ClN2O5S3
  • H donors: 1 H acceptors: 5 LogP: 4.98 Rotable bonds: 8
    Rule of 5 violations (Lipinski): 1
  • SMILES: COc1ccccc1CNc1sc(nc1S(=O)(=O)c1ccc(cc1)Cl)S(=O)(=O)CC
  • InChi: 1S/C19H19ClN2O5S3/c1-3-29(23,24)19-22-18(30(25,26)15-10-8-14(20)9-11-15)17(28-19)21-12-13-6-4-5-7-16(13)27-2/h4-11,21H,3,12H2,1-2H3
  • InChiKey: IJJZCNDJYRYCTK-UHFFFAOYSA-N  

Network

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Synonyms

  • 4-(4-chlorophenyl)sulfonyl-2-ethylsulfonyl-N-[(2-methoxyphenyl)methyl]thiazol-5-amine
  • 4-(4-chlorophenyl)sulfonyl-2-ethylsulfonyl-N-[(2-methoxyphenyl)methyl]-5-thiazolamine
  • [4-(4-chlorophenyl)sulfonyl-2-ethylsulfonyl-thiazol-5-yl]-(2-methoxybenzyl)amine

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 0.0126 0.2956 0.3262
Brugia malayi Chymotrypsin-like protease CTRL-1 precursor 0.0075 0.1468 0.0912
Onchocerca volvulus 0.0075 0.1468 0.1013
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0334 0.9064 0.9003
Schistosoma mansoni hypothetical protein 0.0075 0.1468 0.0912
Plasmodium falciparum dihydroorotate dehydrogenase 0.0365 1 1
Brugia malayi Protein kinase domain containing protein 0.0126 0.2956 0.2497
Loa Loa (eye worm) DOMON domain-containing protein 0.0046 0.0612 0.0675
Echinococcus granulosus subfamily S1A unassigned peptidase S01 family 0.0075 0.1468 0.4224
Echinococcus granulosus tissue type plasminogen activator 0.0126 0.2956 0.8557
Brugia malayi Trypsin family protein 0.0075 0.1468 0.0912
Echinococcus granulosus enteropeptidase 0.0075 0.1468 0.4224
Loa Loa (eye worm) hypothetical protein 0.0075 0.1468 0.162
Onchocerca volvulus 0.0334 0.9064 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.1468 0.0912
Echinococcus multilocularis tissue type plasminogen activator 0.0126 0.2956 0.8557
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0143 0.3452 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.1468 0.0912
Onchocerca volvulus 0.0075 0.1468 0.1013
Brugia malayi Trypsin-like protease protein 5 0.0075 0.1468 0.0912
Brugia malayi Trypsin family protein 0.0075 0.1468 0.0912
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0143 0.3452 0.5
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0365 1 1
Brugia malayi Muscle positioning protein 4 0.0051 0.0759 0.0156
Echinococcus granulosus Peptidase S1 S6 chymotrypsin Hap 0.0075 0.1468 0.4224
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0143 0.3452 0.0704
Loa Loa (eye worm) trypsin family protein 0.0075 0.1468 0.162
Mycobacterium leprae Probable dihydroorotate dehydrogenase PyrD 0.0365 1 0.5
Trypanosoma cruzi dihydroorotate dehydrogenase (fumarate), putative 0.0365 1 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.1468 0.0912
Entamoeba histolytica dihydropyrimidine dehydrogenase, putative 0.0143 0.3452 0.5
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0079 0.1581 0.1032
Echinococcus granulosus glycoprotein Antigen 5 0.0075 0.1468 0.4224
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0075 0.1468 0.0912
Loa Loa (eye worm) hypothetical protein 0.0075 0.1468 0.162
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.1468 0.0912
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.1468 0.0912
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.1468 0.0912
Brugia malayi Dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.0365 1 1
Trypanosoma cruzi dihydroorotate dehydrogenase, putative 0.0365 1 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.1468 0.0912
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.1468 0.0912
Schistosoma mansoni hypothetical protein 0.0075 0.1468 0.0912
Onchocerca volvulus 0.0075 0.1468 0.1013
Loa Loa (eye worm) hypothetical protein 0.0046 0.0612 0.0675
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.1468 0.0912
Echinococcus multilocularis enteropeptidase 0.0075 0.1468 0.4224
Brugia malayi Kringle domain containing protein 0.0126 0.2956 0.2497
Loa Loa (eye worm) hypothetical protein 0.0334 0.9064 1
Trypanosoma brucei dihydroorotate dehydrogenase (fumarate) 0.0365 1 0.5
Onchocerca volvulus 0.0126 0.2956 0.2773
Echinococcus granulosus transmembrane protease serine 3 0.0075 0.1468 0.4224
Echinococcus multilocularis dihydropyrimidine dehydrogenase (NADP+) 0.0143 0.3452 1
Loa Loa (eye worm) hypothetical protein 0.0075 0.1468 0.162
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0143 0.3452 0.5
Brugia malayi Trypsin family protein 0.0075 0.1468 0.0912
Brugia malayi hypothetical protein 0.0075 0.1468 0.0912
Echinococcus multilocularis Peptidase S1 S6, chymotrypsin Hap 0.0075 0.1468 0.4224
Echinococcus multilocularis subfamily S1A unassigned peptidase (S01 family) 0.0075 0.1468 0.4224
Onchocerca volvulus 0.0075 0.1468 0.1013
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0143 0.3452 0.5
Echinococcus granulosus Mastin 0.0075 0.1468 0.4224
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0143 0.3452 1
Leishmania major dihydroorotate dehydrogenase 0.0365 1 1
Brugia malayi Zinc finger, C2H2 type family protein 0.0143 0.3452 0.3025
Loa Loa (eye worm) TK/ROR protein kinase 0.0126 0.2956 0.3262
Brugia malayi Trypsin family protein 0.0334 0.9064 0.9003
Toxoplasma gondii dihydroorotate dehydrogenase reveal, putative 0.0365 1 1
Schistosoma mansoni hypothetical protein 0.0126 0.2956 0.2497
Trichomonas vaginalis dihydropyrimidine dehydrogenase, putative 0.0143 0.3452 0.5
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.1468 0.0912
Loa Loa (eye worm) hypothetical protein 0.0051 0.0759 0.0837
Loa Loa (eye worm) hypothetical protein 0.0334 0.9064 1
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0346 0.9423 0.9386
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0075 0.1468 0.0912
Onchocerca volvulus 0.0051 0.0759 0.0173
Loa Loa (eye worm) hypothetical protein 0.0075 0.1468 0.162
Onchocerca volvulus 0.0075 0.1468 0.1013
Echinococcus multilocularis transmembrane protease serine 3 0.0075 0.1468 0.4224
Loa Loa (eye worm) hypothetical protein 0.0075 0.1468 0.162
Plasmodium vivax dihydroorotate dehydrogenase, mitochondrial precursor, putative 0.0365 1 1
Schistosoma mansoni cercarial elastase (S01 family) 0.0075 0.1468 0.0912
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0075 0.1468 0.0912
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0075 0.1468 0.0912
Mycobacterium ulcerans dihydroorotate dehydrogenase 2 0.0365 1 1
Echinococcus multilocularis glycoprotein Antigen 5 0.0075 0.1468 0.4224
Mycobacterium tuberculosis Probable dihydroorotate dehydrogenase PyrD 0.0365 1 0.5
Schistosoma mansoni dihydroorotate dehydrogenase 0.0365 1 1
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0143 0.3452 0.5
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0075 0.1468 0.0912
Wolbachia endosymbiont of Brugia malayi dihydroorotate dehydrogenase 2 0.0365 1 0.5
Onchocerca volvulus 0.0258 0.6853 0.7384
Echinococcus multilocularis Mastin 0.0075 0.1468 0.4224
Echinococcus granulosus dihydropyrimidine dehydrogenase NADP 0.0143 0.3452 1
Trichomonas vaginalis dihydroorotate dehydrogenase, putative 0.0143 0.3452 0.5

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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