TDR Targets

Basic information

Technical information

TDR Targets ID: 685140
Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl] -3-methylsulfanylbenzamide
MW: 370.445 | Formula: C18H14N2O3S2
H donors: 1 H acceptors: 2 LogP: 4.11 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CSc1cccc(c1)C(=O)Nc1scc(n1)c1ccc2c(c1)OCO2
InChi: 1S/C18H14N2O3S2/c1-24-13-4-2-3-12(7-13)17(21)20-18-19-14(9-25-18)11-5-6-15-16(8-11)23-10-22-15/h2-9H,10H2,1H3,(H,19,20,21)
InChiKey: HYGGIHOJGWHSFH-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-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-methylsulfanyl-benzamide
N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-3-(methylthio)benzamide
N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-(methylthio)benzamide
N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-methylsulfanyl-benzamide
ZINC04517494

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
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0039	0.1473	0.0931
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0039	0.1473	0.1473
Plasmodium vivax	unspecified product	0.0027	0.0597	0.4054
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0157	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0039	0.1473	0.1473
Trypanosoma cruzi	cysteine peptidase, putative	0.0027	0.0597	0.0597
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Entamoeba histolytica	cysteine proteinase, putative	0.0031	0.0876	0.5946
Echinococcus multilocularis	cathepsin L cysteine protease	0.0039	0.1473	0.1473
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0039	0.1473	0.1473
Trypanosoma cruzi	cysteine peptidase, putative	0.0039	0.1473	0.1473
Echinococcus granulosus	cathepsin l1	0.0031	0.0876	0.0876
Brugia malayi	Cathepsin L-like precursor	0.0039	0.1473	0.1473
Trypanosoma cruzi	cysteine peptidase, putative	0.0039	0.1473	0.1473
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0039	0.1473	0.0931
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Entamoeba histolytica	cysteine proteinase, putative	0.0039	0.1473	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0039	0.1473	0.1473
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0027	0.0597	0.0597
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Brugia malayi	Papain family cysteine protease containing protein	0.0027	0.0597	0.0597
Schistosoma mansoni	cathepsin F (C01 family)	0.0031	0.0876	0.0876
Entamoeba histolytica	cysteine proteinase, putative	0.0027	0.0597	0.4054
Brugia malayi	Cathepsin L-like precursor	0.0031	0.0876	0.0876
Entamoeba histolytica	cysteine proteinase 1, putative	0.0027	0.0597	0.4054
Giardia lamblia	Cathepsin B precursor	0.0157	1	1
Brugia malayi	Cathepsin L-like precursor	0.0031	0.0876	0.0876
Onchocerca volvulus		0.0039	0.1473	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0039	0.1473	0.0931
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Entamoeba histolytica	cysteine proteinase 2	0.0027	0.0597	0.4054
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0039	0.1473	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0876	0.0876
Schistosoma mansoni	cathepsin F (C01 family)	0.0039	0.1473	0.1473
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0031	0.0876	0.0876
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0031	0.0876	0.0876
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0039	0.1473	0.0931
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0031	0.0876	0.0876
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0027	0.0597	0.0597
Loa Loa (eye worm)	cysteine protease	0.0039	0.1473	0.1473
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0039	0.1473	0.1473
Trypanosoma cruzi	cysteine proteinase, putative	0.0027	0.0597	0.0597
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0157	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0039	0.1473	1
Brugia malayi	cathepsin L-like precursor	0.0031	0.0876	0.0876
Echinococcus multilocularis	cysteine protease	0.0039	0.1473	0.1473
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0039	0.1473	0.1473
Trypanosoma cruzi	cruzipain precursor, putative	0.0039	0.1473	0.1473
Loa Loa (eye worm)	hypothetical protein	0.0157	1	1
Loa Loa (eye worm)	cathepsin B	0.0157	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0039	0.1473	0.1473
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0039	0.1473	0.1473
Onchocerca volvulus		0.0031	0.0876	0.5946
Entamoeba histolytica	cysteine proteinase, putative	0.0027	0.0597	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Onchocerca volvulus		0.0039	0.1473	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0039	0.1473	0.1473
Echinococcus multilocularis	cysteine protease	0.0039	0.1473	0.1473
Toxoplasma gondii	cathepsin CPL	0.0039	0.1473	0.1473
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0039	0.1473	1
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0157	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0027	0.0597	0.0597
Brugia malayi	Cathepsin L-like precursor	0.0039	0.1473	0.1473
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0039	0.1473	0.0931
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0597	0.0597
Plasmodium vivax	vivapain-2	0.0039	0.1473	1
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0039	0.1473	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0031	0.0876	0.0876
Giardia lamblia	Cathepsin B precursor	0.0157	1	1
Brugia malayi	Cathepsin L-like precursor	0.0039	0.1473	0.1473
Trypanosoma cruzi	cysteine protease, putative	0.0027	0.0597	0.0597
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0157	1	1
Echinococcus granulosus	cathepsin L cysteine protease	0.0027	0.0597	0.0597
Brugia malayi	Cathepsin L-like precursor	0.0039	0.1473	0.1473
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0027	0.0597	0.0597
Plasmodium vivax	vivapain-3	0.0027	0.0597	0.4054
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0039	0.1473	0.0931
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0157	1	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.0039	0.1473	0.1473
Onchocerca volvulus		0.0039	0.1473	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0039	0.1473	1
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0157	1	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0039	0.1473	0.1473
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0039	0.1473	0.0931
Toxoplasma gondii	cathepsin B	0.0157	1	1
Onchocerca volvulus	Cathepsin F homolog	0.0039	0.1473	1
Loa Loa (eye worm)	fibroinase	0.0039	0.1473	0.1473
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0157	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Brugia malayi	Cathepsin L-like precursor	0.0039	0.1473	0.1473
Loa Loa (eye worm)	ctsf protein	0.0039	0.1473	0.1473
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0027	0.0597	0.4054
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0039	0.1473	0.1473
Entamoeba histolytica	cysteine proteinase, putative	0.0027	0.0597	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Onchocerca volvulus	Cathepsin L homolog	0.0039	0.1473	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0039	0.1473	0.0931
Onchocerca volvulus		0.0039	0.1473	1
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Onchocerca volvulus		0.0039	0.1473	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Onchocerca volvulus	Cathepsin L homolog	0.0039	0.1473	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0039	0.1473	0.1473
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0039	0.1473	0.0931
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0157	1	1
Trypanosoma cruzi	cysteine proteinase, putative	0.0027	0.0597	0.0597
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0039	0.1473	1
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0157	1	1
Echinococcus multilocularis	cathepsin b	0.0157	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0039	0.1473	0.1473
Brugia malayi	Papain family cysteine protease containing protein	0.0027	0.0597	0.0597
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0039	0.1473	0.0931
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0039	0.1473	0.1473
Schistosoma mansoni	cathepsin F (C01 family)	0.0039	0.1473	0.1473
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0157	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0039	0.1473	0.1473
Echinococcus granulosus	cathepsin l1	0.0039	0.1473	0.1473
Trypanosoma cruzi	cysteine peptidase, putative	0.0039	0.1473	0.1473
Plasmodium vivax	vivapain-2	0.0039	0.1473	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Plasmodium vivax	vivapain-1	0.0027	0.0597	0.4054
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0597	0.4054
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0876	0.0876
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0597	0.0597
Echinococcus granulosus	cathepsin b	0.0157	1	1
Giardia lamblia	Cathepsin B precursor	0.0157	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0039	0.1473	0.0931
Onchocerca volvulus		0.0039	0.1473	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Echinococcus multilocularis	cathepsin b	0.0157	1	1
Brugia malayi	Cathepsin L-like precursor	0.0039	0.1473	0.1473
Echinococcus multilocularis	cathepsin L	0.0027	0.0597	0.0597
Trypanosoma cruzi	cysteine peptidase, putative	0.0039	0.1473	0.1473
Echinococcus granulosus	cathepsin b	0.0157	1	1
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0039	0.1473	0.1473
Entamoeba histolytica	cysteine proteinase, putative	0.0027	0.0597	0.4054
Brugia malayi	Papain family cysteine protease containing protein	0.0039	0.1473	0.1473
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0039	0.1473	0.1473
Echinococcus granulosus	cathepsin L	0.0027	0.0597	0.0597
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0876	0.0876
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0039	0.1473	0.1473
Onchocerca volvulus		0.0039	0.1473	1
Echinococcus granulosus	cysteine protease	0.0027	0.0597	0.0597

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 685140