TDR Targets

Basic information

Technical information

TDR Targets ID: 625766
Name: 1-naphthalen-2-ylsulfonyl-2-[[3-(trifluoromet hyl)phenyl]methylsulfanyl]-4,5-dihydroimidazo le
MW: 450.497 | Formula: C21H17F3N2O2S2
H donors: 0 H acceptors: 2 LogP: 5.11 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: O=S(=O)(N1CCN=C1SCc1cccc(c1)C(F)(F)F)c1ccc2c(c1)cccc2
InChi: 1S/C21H17F3N2O2S2/c22-21(23,24)18-7-3-4-15(12-18)14-29-20-25-10-11-26(20)30(27,28)19-9-8-16-5-1-2-6-17(16)13-19/h1-9,12-13H,10-11,14H2
InChiKey: XJZIYEAZFGXLRV-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

1-(2-naphthylsulfonyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]-4,5-dihydroimidazole
1-(2-naphthylsulfonyl)-2-[[3-(trifluoromethyl)phenyl]methylthio]-4,5-dihydroimidazole
1-(2-naphthylsulfonyl)-2-[[3-(trifluoromethyl)benzyl]thio]-4,5-dihydroimidazole
ZINC02711676

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	lamin	0.0026	0.0999	0.32
Echinococcus multilocularis	musashi	0.0026	0.0999	0.32
Echinococcus granulosus	intermediate filament protein	0.0026	0.0999	0.32
Leishmania major	hypothetical protein, conserved	0.0035	0.14	0.5
Brugia malayi	TAR-binding protein	0.0066	0.2818	1
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0035	0.14	0.5
Echinococcus multilocularis	tar DNA binding protein	0.0066	0.2818	1
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.14	0.4968
Loa Loa (eye worm)	RNA binding protein	0.0066	0.2818	1
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0035	0.14	0.4527
Trypanosoma brucei	hypothetical protein, conserved	0.0035	0.14	0.5
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0035	0.14	0.4698
Echinococcus multilocularis	lamin dm0	0.0026	0.0999	0.32
Brugia malayi	cytoplasmic intermediate filament protein	0.0014	0.0444	0.0859
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0227	0.0311
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0035	0.14	0.4539
Schistosoma mansoni	intermediate filament proteins	0.0026	0.0999	0.3546
Echinococcus granulosus	lamin	0.0026	0.0999	0.32
Echinococcus multilocularis	cpg binding protein	0.0032	0.1248	0.4131
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.14	1
Loa Loa (eye worm)	CXXC zinc finger family protein	0.003	0.1171	0.3642
Loa Loa (eye worm)	hypothetical protein	0.0035	0.14	0.4527
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.2818	1
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0007	0.0143	0.0509
Loa Loa (eye worm)	hypothetical protein	0.0035	0.14	0.4527
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.14	0.4968
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.14	0.5
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0013	0.0381	0.0888
Brugia malayi	intermediate filament protein	0.0026	0.0999	0.2996
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0014	0.0444	0.084
Trichomonas vaginalis	esterase, putative	0.0035	0.14	1
Mycobacterium ulcerans	lipase LipD	0.0035	0.14	0.5
Brugia malayi	beta-lactamase family protein	0.0035	0.14	0.4539
Mycobacterium ulcerans	esterase/lipase LipP	0.0035	0.14	0.5
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0013	0.0381	0.0888
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.14	1
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0057	0.2393	1
Plasmodium vivax	hypothetical protein, conserved	0.0035	0.14	0.5
Brugia malayi	Intermediate filament tail domain containing protein	0.0026	0.0999	0.2996
Loa Loa (eye worm)	TAR-binding protein	0.0066	0.2818	1
Loa Loa (eye worm)	intermediate filament protein	0.0026	0.0999	0.2981
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.14	0.5
Mycobacterium leprae	conserved hypothetical protein	0.0035	0.14	0.5
Schistosoma mansoni	cpg binding protein	0.0032	0.1248	0.443
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0064	0.2703	0.959
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0066	0.2818	1
Onchocerca volvulus		0.003	0.1171	0.4273
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.14	1
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.2818	1
Schistosoma mansoni	lamin	0.0026	0.0999	0.3546
Mycobacterium ulcerans	hypothetical protein	0.0035	0.14	0.5
Brugia malayi	RNA binding protein	0.0066	0.2818	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.14	0.4527
Echinococcus granulosus	cpg binding protein	0.0032	0.1248	0.4131
Onchocerca volvulus		0.0035	0.14	1
Schistosoma mansoni	lamin	0.0026	0.0999	0.3546
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0977	0.2897
Echinococcus granulosus	lamin dm0	0.0026	0.0999	0.32
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.2818	1
Brugia malayi	RNA recognition motif domain containing protein	0.0066	0.2818	1
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.14	1
Schistosoma mansoni	cpg binding protein	0.003	0.1171	0.4154
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0026	0.0999	0.2981
Schistosoma mansoni	cpg binding protein	0.0032	0.1248	0.443
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.2818	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.14	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.14	0.4527
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0227	0.0311
Brugia malayi	beta-lactamase family protein	0.0035	0.14	0.4539
Mycobacterium ulcerans	beta-lactamase	0.0035	0.14	0.5
Echinococcus granulosus	beta LACTamase domain containing family member	0.0035	0.14	0.4698
Brugia malayi	beta-lactamase	0.0035	0.14	0.4539
Brugia malayi	CXXC zinc finger family protein	0.003	0.1171	0.3655
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0359	0.051
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0999	0.2981
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0359	0.051
Onchocerca volvulus		0.0035	0.14	1
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0381	0.0595
Loa Loa (eye worm)	hypothetical protein	0.0035	0.14	0.4527
Loa Loa (eye worm)	hypothetical protein	0.0035	0.14	0.4527
Loa Loa (eye worm)	beta-lactamase	0.0035	0.14	0.4527
Schistosoma mansoni	tar DNA-binding protein	0.0066	0.2818	1
Echinococcus granulosus	tar DNA binding protein	0.0066	0.2818	1
Mycobacterium leprae	Probable lipase LipE	0.0035	0.14	0.5
Onchocerca volvulus		0.0035	0.14	1

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 625766