TDR Targets

Basic information

Technical information

TDR Targets ID: 620407
Name: N-(5-chloro-2-methoxyphenyl)-2-[1-(4-fluoroph enyl)imidazol-2-yl]sulfanylacetamide
MW: 391.847 | Formula: C18H15ClFN3O2S
H donors: 1 H acceptors: 2 LogP: 4.12 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: COc1ccc(cc1NC(=O)CSc1nccn1c1ccc(cc1)F)Cl
InChi: 1S/C18H15ClFN3O2S/c1-25-16-7-2-12(19)10-15(16)22-17(24)11-26-18-21-8-9-23(18)14-5-3-13(20)4-6-14/h2-10H,11H2,1H3,(H,22,24)
InChiKey: OUQLTGBLJAPRML-UHFFFAOYSA-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

N-(5-chloro-2-methoxy-phenyl)-2-[1-(4-fluorophenyl)imidazol-2-yl]sulfanyl-acetamide
N-(5-chloro-2-methoxyphenyl)-2-[[1-(4-fluorophenyl)-2-imidazolyl]thio]acetamide
N-(5-chloro-2-methoxy-phenyl)-2-[[1-(4-fluorophenyl)imidazol-2-yl]thio]acetamide
N-(5-chloro-2-methoxy-phenyl)-2-[1-(4-fluorophenyl)imidazol-2-yl]sulfanyl-ethanamide
EU-0058013
ZINC02723644

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
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0294	0.0822
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.001	0.0466	0.1303
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.001	0.0466	0.0466
Onchocerca volvulus	Protein ultraspiracle homolog	0.001	0.0466	1
Echinococcus multilocularis	thyroid hormone receptor alpha	0.001	0.0466	0.1303
Brugia malayi	nuclear receptor RXR	0.0005	0.005	0.005
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.001	0.0466	0.0466
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0008	0.0294	0.0822
Loa Loa (eye worm)	hypothetical protein	0.001	0.0466	0.0466
Loa Loa (eye worm)	MH2 domain-containing protein	0.0008	0.0294	0.0294
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.001	0.0466	0.0466
Schistosoma mansoni	thyroid hormone receptor	0.001	0.0466	0.1303
Loa Loa (eye worm)	hypothetical protein	0.0005	0.005	0.005
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0294	0.0822
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0466	0.0466
Schistosoma mansoni	Smad4	0.0008	0.0294	0.0822
Schistosoma mansoni	smad	0.0008	0.0294	0.0822
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.3575	1
Loa Loa (eye worm)	hypothetical protein	0.0005	0.005	0.005
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0466	0.1303
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.001	0.0466	0.0466
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.3575	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.3575	1
Loa Loa (eye worm)	hypothetical protein	0.001	0.0466	0.0466
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.001	0.0466	0.1303
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0008	0.0294	0.0822
Brugia malayi	photoreceptor-specific nuclear receptor	0.001	0.0466	0.0466
Schistosoma mansoni	RAR-like nuclear receptor	0.001	0.0466	0.1303
Schistosoma mansoni	nuclear hormone receptor	0.001	0.0466	0.1303
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.001	0.0466	1
Echinococcus multilocularis	smad	0.0008	0.0294	0.0822
Onchocerca volvulus		0.001	0.0466	1
Brugia malayi	Steroid receptor seven-up type 2	0.001	0.0466	0.0466
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.001	0.0466	0.1303
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0466	0.0466
Brugia malayi	nuclear receptor NHR-88	0.001	0.0466	0.0466
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0466	0.1303
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.3575	1
Loa Loa (eye worm)	steroid hormone receptor	0.001	0.0466	0.0466
Schistosoma mansoni	retinoic acid receptor RXR	0.001	0.0466	0.1303
Loa Loa (eye worm)	hypothetical protein	0.0005	0.005	0.005
Brugia malayi	MH2 domain containing protein	0.0008	0.0294	0.0294
Brugia malayi	hypothetical protein	0.0035	0.2723	0.2723
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.001	0.0466	0.0466
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.001	0.0466	0.0466
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0005	0.005	0.014
Echinococcus granulosus	ecdysone induced protein 78C	0.001	0.0466	0.1303
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0466	0.1303
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.2723	0.7617
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.001	0.0466	0.1303
Brugia malayi	steroid hormone receptor	0.001	0.0466	0.0466
Loa Loa (eye worm)	hypothetical protein	0.001	0.0466	0.0466
Brugia malayi	ecdysteroid receptor	0.001	0.0466	0.0466
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.2723	0.7617
Echinococcus multilocularis	Smad4	0.0008	0.0294	0.0822
Loa Loa (eye worm)	transcription factor SMAD2	0.0117	1	1
Brugia malayi	nuclear hormone receptor	0.001	0.0466	0.0466
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.001	0.0466	0.1303
Schistosoma mansoni	steroid hormone receptor ad4bp	0.001	0.0466	0.1303
Onchocerca volvulus	Bile acid receptor homolog	0.001	0.0466	1
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.001	0.0466	0.0466
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.3575	1
Loa Loa (eye worm)	MH2 domain-containing protein	0.0117	1	1
Loa Loa (eye worm)	hypothetical protein	0.0005	0.005	0.005
Brugia malayi	hypothetical protein	0.0005	0.005	0.005
Entamoeba histolytica	hypothetical protein	0.0035	0.2723	0.5
Echinococcus multilocularis	ecdysone induced protein 78C	0.001	0.0466	0.1303
Echinococcus granulosus	mothers against decapentaplegic 5	0.0008	0.0294	0.0822
Loa Loa (eye worm)	hypothetical protein	0.001	0.0466	0.0466
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0005	0.005	0.014
Brugia malayi	MH1 domain containing protein	0.0008	0.0294	0.0294
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0005	0.005	0.014
Echinococcus granulosus	Smad4	0.0008	0.0294	0.0822
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.001	0.0466	0.1303
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0466	0.1303
Entamoeba histolytica	hypothetical protein	0.0035	0.2723	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.001	0.0466	0.0466
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.001	0.0466	0.0466
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0466	0.0466
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0008	0.0294	0.0822
Brugia malayi	hypothetical protein	0.0005	0.005	0.005
Brugia malayi	Nuclear hormone receptor-like 1	0.0005	0.005	0.005
Loa Loa (eye worm)	hypothetical protein	0.001	0.0466	0.0466
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.001	0.0466	0.0466
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.001	0.0466	0.1303
Brugia malayi	MH2 domain containing protein	0.0008	0.0294	0.0294
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.001	0.0466	0.1303
Loa Loa (eye worm)	Smad1	0.0008	0.0294	0.0294
Loa Loa (eye worm)	MH1 domain-containing protein	0.0008	0.0294	0.0294
Loa Loa (eye worm)	hypothetical protein	0.001	0.0466	0.0466
Brugia malayi	Nuclear hormone receptor-like 1	0.001	0.0466	0.0466
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0466	0.0466
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.3575	1
Echinococcus multilocularis	FTZ F1 alpha	0.001	0.0466	0.1303
Schistosoma mansoni	hypothetical protein	0.0035	0.2723	0.7617
Loa Loa (eye worm)	hypothetical protein	0.0005	0.005	0.005
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0466	0.0466
Loa Loa (eye worm)	hypothetical protein	0.001	0.0466	0.0466
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.001	0.0466	0.0466
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.001	0.0466	0.1303
Echinococcus granulosus	FTZ F1 alpha	0.001	0.0466	0.1303
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0005	0.005	0.005
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0005	0.005	0.014
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.3575	0.3575
Entamoeba histolytica	hypothetical protein	0.0035	0.2723	0.5
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.001	0.0466	0.1303
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.2723	0.7617
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.001	0.0466	0.1303
Brugia malayi	Nuclear hormone receptor-like 1	0.0005	0.005	0.005
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.001	0.0466	0.0466
Brugia malayi	Smad1	0.0008	0.0294	0.0294
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.001	0.0466	0.1303
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.001	0.0466	0.1303
Brugia malayi	MH1 domain containing protein	0.0008	0.0294	0.0294
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0008	0.0294	0.0822
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0294	0.0822
Entamoeba histolytica	hypothetical protein	0.0035	0.2723	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0466	0.0466
Schistosoma mansoni	thyroid hormone receptor	0.001	0.0466	0.1303
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.3575	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.001	0.0466	0.0466
Loa Loa (eye worm)	hypothetical protein	0.001	0.0466	0.0466
Schistosoma mansoni	coup transcription factor	0.001	0.0466	0.1303
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.001	0.0466	0.1303
Echinococcus granulosus	smad	0.0008	0.0294	0.0822
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.001	0.0466	0.0466
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.001	0.0466	0.1303
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.3575	0.3575

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 620407