TDR Targets

Basic information

Technical information

TDR Targets ID: 874759
Name: (4E)-4-[(3-bromo-4-methoxyphenyl)methylidene] -2-(3,4-dichlorophenyl)-5-methylpyrazol-3-one
MW: 440.118 | Formula: C18H13BrCl2N2O2
H donors: 0 H acceptors: 1 LogP: 5.31 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(cc1Br)C=C1C(=NN(C1=O)c1ccc(c(c1)Cl)Cl)C
InChi: 1S/C18H13BrCl2N2O2/c1-10-13(7-11-3-6-17(25-2)14(19)8-11)18(24)23(22-10)12-4-5-15(20)16(21)9-12/h3-9H,1-2H3/b13-7+
InChiKey: FGJAAUYGCYCBBX-NTUHNPAUSA-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-[(3-bromo-4-methoxyphenyl)methylidene]-2-(3,4-dichlorophenyl)-5-methylpyrazol-3-one
(4E)-4-[(3-bromo-4-methoxy-phenyl)methylene]-2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-one
4-[(3-bromo-4-methoxy-phenyl)methylene]-2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-one
(4E)-4-[(3-bromo-4-methoxyphenyl)methylene]-2-(3,4-dichlorophenyl)-5-methyl-3-pyrazolone
4-[(3-bromo-4-methoxyphenyl)methylene]-2-(3,4-dichlorophenyl)-5-methyl-3-pyrazolone
(4E)-4-(3-bromo-4-methoxy-benzylidene)-2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-one
4-(3-bromo-4-methoxy-benzylidene)-2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-one
(4E)-4-[(3-bromo-4-methoxy-phenyl)methylidene]-2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-one
4-[(3-bromo-4-methoxy-phenyl)methylidene]-2-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-one

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	FTZ F1 alpha	0.0022	0.0942	0.1681
Echinococcus granulosus	ecdysone induced protein 78C	0.0022	0.0942	0.1681
Loa Loa (eye worm)	steroid hormone receptor	0.0022	0.0942	0.0942
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0942	0.0942
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0022	0.0942	0.0942
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0036	0.5602	1
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0022	0.0942	0.0942
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0022	0.0942	0.1681
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0022	0.0942	0.1681
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0022	0.0942	0.0942
Echinococcus granulosus	FTZ F1 alpha	0.0022	0.0942	0.1681
Brugia malayi	nuclear receptor NHR-88	0.0022	0.0942	0.0942
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0	0.5
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0022	0.0942	0.1681
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0022	0.0942	0.1681
Schistosoma mansoni	nuclear hormone receptor	0.0022	0.0942	0.1681
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0022	0.0942	0.0942
Onchocerca volvulus	Bile acid receptor homolog	0.0022	0.0942	0.5
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0019	0	0.5
Schistosoma mansoni	transcription factor LCR-F1	0.0036	0.5602	1
Echinococcus multilocularis	ecdysone induced protein 78C	0.0022	0.0942	0.1681
Loa Loa (eye worm)	hypothetical protein	0.0049	1	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0022	0.0942	0.0942
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0022	0.0942	0.0942
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0	0.5
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0022	0.0942	0.1681
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0022	0.0942	0.1681
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0049	1	1
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0022	0.0942	0.0942
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0019	0	0.5
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0049	1	1
Schistosoma mansoni	hypothetical protein	0.0036	0.5602	1
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0	0.5
Toxoplasma gondii	exonuclease III APE	0.0019	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0942	0.0942
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0022	0.0942	0.1681
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0022	0.0942	0.0942
Brugia malayi	steroid hormone receptor	0.0022	0.0942	0.0942
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0022	0.0942	0.0942
Brugia malayi	ecdysteroid receptor	0.0022	0.0942	0.0942
Onchocerca volvulus	Protein ultraspiracle homolog	0.0022	0.0942	0.5
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0	0.5
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0022	0.0942	0.0942
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.4846	0.4846
Entamoeba histolytica	hypothetical protein	0.0036	0.5602	1
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0022	0.0942	0.0942
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0942	0.0942
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0022	0.0942	0.0942
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0033	0.4846	0.4846
Schistosoma mansoni	thyroid hormone receptor	0.0022	0.0942	0.1681
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0022	0.0942	0.1681
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0022	0.0942	0.1681
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0942	0.0942
Brugia malayi	photoreceptor-specific nuclear receptor	0.0022	0.0942	0.0942
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0022	0.0942	0.1681
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0019	0	0.5
Entamoeba histolytica	hypothetical protein	0.0036	0.5602	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0022	0.0942	0.1681
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0022	0.0942	0.0942
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0022	0.0942	0.1681
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0022	0.0942	0.1681
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0019	0	0.5
Schistosoma mansoni	hypothetical protein	0.0033	0.4846	0.8652
Schistosoma mansoni	thyroid hormone receptor	0.0022	0.0942	0.1681
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0022	0.0942	0.1681
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0022	0.0942	0.0942
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0942	0.0942
Schistosoma mansoni	coup transcription factor	0.0022	0.0942	0.1681
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0022	0.0942	0.1681
Schistosoma mansoni	retinoic acid receptor RXR	0.0022	0.0942	0.1681
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0022	0.0942	0.1681
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0022	0.0942	0.1681
Schistosoma mansoni	RAR-like nuclear receptor	0.0022	0.0942	0.1681
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0022	0.0942	0.5
Entamoeba histolytica	hypothetical protein	0.0036	0.5602	1
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0022	0.0942	0.1681
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0022	0.0942	0.1681
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0022	0.0942	0.1681
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0022	0.0942	0.0942
Brugia malayi	hypothetical protein	0.0036	0.5602	0.5602
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0022	0.0942	0.0942
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0022	0.0942	0.0942
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0942	0.0942
Brugia malayi	Steroid receptor seven-up type 2	0.0022	0.0942	0.0942
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0022	0.0942	0.0942
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0942	0.0942
Entamoeba histolytica	hypothetical protein	0.0036	0.5602	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0022	0.0942	0.0942
Brugia malayi	nuclear hormone receptor	0.0022	0.0942	0.0942
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0022	0.0942	0.0942
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0942	0.0942
Onchocerca volvulus		0.0022	0.0942	0.5
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0022	0.0942	0.0942
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0036	0.5602	1
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0	0.5
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0022	0.0942	0.1681

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

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 874759