TDR Targets

Basic information

Technical information

TDR Targets ID: 1114173
Name: 4-[(E)-2-(4-hydroxyphenyl)ethenyl]-3-methylsu lfonylphenol
MW: 290.334 | Formula: C15H14O4S
H donors: 2 H acceptors: 4 LogP: 2.72 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: Oc1ccc(cc1)/C=C/c1ccc(cc1S(=O)(=O)C)O
InChi: 1S/C15H14O4S/c1-20(18,19)15-10-14(17)9-6-12(15)5-2-11-3-7-13(16)8-4-11/h2-10,16-17H,1H3/b5-2+
InChiKey: KZZIDNAUUIXMTD-GORDUTHDSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

4-[(E)-2-(4-hydroxyphenyl)vinyl]-3-methylsulfonyl-phenol
4-[(E)-2-(4-hydroxyphenyl)vinyl]-3-methylsulfonylphenol
4-[(E)-2-(4-hydroxyphenyl)vinyl]-3-mesyl-phenol
4-[(E)-2-(4-hydroxyphenyl)ethenyl]-3-methylsulfonyl-phenol

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

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	1	1
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0018	0.2941	0.2941
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Schistosoma mansoni	transcription factor LCR-F1	0.0035	1	1
Toxoplasma gondii	LsmAD domain-containing protein	0.0025	0.5647	0.9808
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.5647	0.9617
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0018	0.2941	0.1156
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Loa Loa (eye worm)	phosphatidylinositol 3	0.0018	0.2941	0.5085
Leishmania major	phosphatidylinositol kinase related protein, putative	0.0018	0.2956	0.0054
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0025	0.5755	0.5755
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Loa Loa (eye worm)	phosphatidylinositol 3	0.0018	0.2941	0.5085
Loa Loa (eye worm)	hypothetical protein	0.0025	0.5647	1
Toxoplasma gondii	FATC domain-containing protein	0.0025	0.5755	1
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0018	0.2941	0.2941
Loa Loa (eye worm)	hypothetical protein	0.0022	0.4306	0.7563
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Entamoeba histolytica	hypothetical protein	0.0035	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0018	0.2941	0.4987
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0018	0.2941	0.4987
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.5647	0.5
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0025	0.5755	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0018	0.2941	0.2941
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Echinococcus granulosus	serine protein kinase ATM	0.0025	0.5755	0.5755
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	1	1
Entamoeba histolytica	hypothetical protein	0.0035	1	1
Entamoeba histolytica	hypothetical protein	0.0035	1	1
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0018	0.2941	0.4987
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0018	0.2941	0.1156
Entamoeba histolytica	hypothetical protein	0.0025	0.5755	0.3986
Plasmodium vivax	ataxin-2 like protein, putative	0.0025	0.5647	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0018	0.2941	0.2941
Trypanosoma brucei	PAB1-binding protein , putative	0.0025	0.5647	0.9808
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0018	0.2956	0.0052
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0018	0.2941	0.2941
Giardia lamblia	GTOR	0.0018	0.2941	0.5
Leishmania major	hypothetical protein, conserved	0.0025	0.5647	1
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.5755	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0025	0.5755	1
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0022	0.4306	0.4849
Echinococcus multilocularis	serine protein kinase ATM	0.0025	0.5755	0.5755
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.5647	0.9617
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Entamoeba histolytica	hypothetical protein	0.0035	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Schistosoma mansoni	hypothetical protein	0.0035	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0018	0.2941	0.4987
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0018	0.2941	0.2941
Brugia malayi	hypothetical protein	0.0025	0.5647	0.4547
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0018	0.2941	0.4987
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.5647	0.5
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0025	0.5755	0.4682

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

ChEMBL: CHEMBL1087208

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.

Detailed information for compound 1114173