Detailed information for compound 679824

Basic information

Technical information
  • TDR Targets ID: 679824
  • Name: 5-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-met hoxyphenyl]methylidene]-3-ethyl-1,3-thiazolid ine-2,4-dione
  • MW: 482.775 | Formula: C20H17BrClNO4S
  • H donors: 0 H acceptors: 2 LogP: 5.5 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCN1C(=O)SC(=Cc2cc(Br)c(c(c2)OC)OCc2ccc(cc2)Cl)C1=O
  • InChi: 1S/C20H17BrClNO4S/c1-3-23-19(24)17(28-20(23)25)10-13-8-15(21)18(16(9-13)26-2)27-11-12-4-6-14(22)7-5-12/h4-10H,3,11H2,1-2H3/b17-10-
  • InChiKey: HSINDJUZEDLSTC-YVLHZVERSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (5Z)-5-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxyphenyl]methylidene]-3-ethyl-1,3-thiazolidine-2,4-dione
  • 5-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxy-phenyl]methylene]-3-ethyl-thiazolidine-2,4-dione
  • (5Z)-5-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxy-phenyl]methylene]-3-ethyl-thiazolidine-2,4-dione
  • (5Z)-5-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxyphenyl]methylene]-3-ethylthiazolidine-2,4-dione
  • 5-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxyphenyl]methylene]-3-ethylthiazolidine-2,4-dione
  • (5Z)-5-[3-bromo-4-(4-chlorobenzyl)oxy-5-methoxy-benzylidene]-3-ethyl-thiazolidine-2,4-quinone
  • 5-[3-bromo-4-(4-chlorobenzyl)oxy-5-methoxy-benzylidene]-3-ethyl-thiazolidine-2,4-quinone
  • (5Z)-5-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxy-phenyl]methylidene]-3-ethyl-1,3-thiazolidine-2,4-dione
  • 5-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxy-phenyl]methylidene]-3-ethyl-1,3-thiazolidine-2,4-dione

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
Entamoeba histolytica steroid 5-alpha reductase, putative 0.0311 1 1
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.2951 0.4622
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.2951 0.4622
Toxoplasma gondii 3-oxo-5-alpha-steroid 4-dehydrogenase 0.0311 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.1022 0.1601
Brugia malayi latrophilin 2 splice variant baaae 0.0034 0.062 0.062
Plasmodium vivax 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0947 0.5
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0069 0.179 0.2803
Mycobacterium tuberculosis Probable oxidoreductase 0.0275 0.8791 0.5
Brugia malayi Melibiase family protein 0.0069 0.179 0.179
Loa Loa (eye worm) pigment dispersing factor receptor c 0.005 0.1154 0.1154
Echinococcus granulosus 3 oxo 5 alpha steroid 4 dehydrogenase C terminal 0.0044 0.0947 0.1484
Echinococcus multilocularis muscleblind protein 1 0.015 0.4549 0.7124
Trypanosoma cruzi 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0311 1 1
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.0103 0.2951 0.4622
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.1022 0.1601
Echinococcus granulosus hormone sensitive lipase 0.0204 0.6385 1
Loa Loa (eye worm) hypothetical protein 0.015 0.4549 0.4549
Schistosoma mansoni synaptic glycoprotein sc2 related 0.0044 0.0947 0.1484
Loa Loa (eye worm) hypothetical protein 0.015 0.4549 0.4549
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.0103 0.2951 0.4622
Loa Loa (eye worm) hypothetical protein 0.0044 0.0947 0.0947
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0046 0.1022 0.1022
Brugia malayi Calcitonin receptor-like protein seb-1 0.005 0.1154 0.1154
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0311 1 1
Echinococcus multilocularis synaptic glycoprotein sc2 0.0044 0.0947 0.1484
Loa Loa (eye worm) hypothetical protein 0.0204 0.6385 0.6385
Leishmania major 3-oxo-5-alpha-steroid 4-dehydrogenase-like protein 0.0311 1 0.5
Trypanosoma brucei 3-oxo-5-alpha-steroid 4-dehydrogenase-like, putative 0.0311 1 1
Echinococcus granulosus muscleblind protein 0.015 0.4549 0.7124
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0311 1 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.1022 0.1601
Mycobacterium ulcerans hypothetical protein 0.0311 1 1
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0046 0.1022 0.1022
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.2951 0.4622
Echinococcus multilocularis muscleblind protein 0.015 0.4549 0.7124
Loa Loa (eye worm) hypothetical protein 0.0311 1 1
Loa Loa (eye worm) hypothetical protein 0.0069 0.179 0.179
Loa Loa (eye worm) hypothetical protein 0.0044 0.0947 0.0947
Trypanosoma cruzi 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0311 1 1
Brugia malayi Synaptic glycoprotein SC2 0.0044 0.0947 0.0947
Schistosoma mansoni hormone-sensitive lipase (S09 family) 0.0204 0.6385 1
Onchocerca volvulus 0.0044 0.0947 0.5
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.005 0.1154 0.1154
Echinococcus granulosus synaptic glycoprotein sc2 0.0044 0.0947 0.1484
Schistosoma mansoni synaptic glycoprotein sc2 related 0.0044 0.0947 0.1484
Loa Loa (eye worm) hypothetical protein 0.0034 0.062 0.062
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0069 0.179 0.2803
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.0069 0.179 0.0931
Toxoplasma gondii melibiase subfamily protein 0.0103 0.2951 0.2214
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.1022 0.1601
Plasmodium falciparum polyprenol reductase, putative 0.0044 0.0947 0.5
Schistosoma mansoni hormone-sensitive lipase (S09 family) 0.0204 0.6385 1
Giardia lamblia Synaptic glycoprotein SC2 0.0044 0.0947 0.5
Echinococcus multilocularis 3 oxo 5 alpha steroid 4 dehydrogenase, C terminal 0.0044 0.0947 0.1484
Plasmodium vivax polyprenol reductase, putative 0.0044 0.0947 0.5
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0046 0.1022 0.1601
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.0103 0.2951 0.4622
Echinococcus multilocularis Glycoside hydrolase, family 27 0.0103 0.2951 0.4622
Schistosoma mansoni hypothetical protein 0.0034 0.062 0.0971
Schistosoma mansoni hormone-sensitive lipase (S09 family) 0.0204 0.6385 1
Trichomonas vaginalis 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0311 1 1
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0046 0.1022 0.1601
Brugia malayi Muscleblind-like protein 0.015 0.4549 0.4549
Echinococcus multilocularis hormone sensitive lipase 0.0204 0.6385 1
Plasmodium falciparum 3-oxo-5-alpha-steroid 4-dehydrogenase, putative 0.0044 0.0947 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0046 0.1022 0.1601
Loa Loa (eye worm) hypothetical protein 0.005 0.1154 0.1154

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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.