TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 336.621 | Formula: C12H8Cl3NO2S
H donors: 0 H acceptors: 2 LogP: 4.58 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: COC(=O)c1sc(nc1C(Cl)Cl)c1ccc(cc1)Cl
InChi: 1S/C12H8Cl3NO2S/c1-18-12(17)9-8(10(14)15)16-11(19-9)6-2-4-7(13)5-3-6/h2-5,10H,1H3
InChiKey: NNZPYLGQDXLWRX-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

No synonyms found for this compound

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 granulosus	expressed protein	0.0277	0.1274	0.1533
Echinococcus granulosus	twitchin	0.0086	0.0109	0.0131
Schistosoma mansoni	nephrin	0.0079	0.0065	0.0065
Loa Loa (eye worm)	hypothetical protein	0.0277	0.1274	0.1274
Loa Loa (eye worm)	RGS-3 protein	0.0277	0.1274	0.1274
Echinococcus granulosus	neurotracting:lsamp:neurotrimin:obcam	0.0079	0.0065	0.0079
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0065	0.0065
Loa Loa (eye worm)	G protein signaling regulator EGL-10	0.0277	0.1274	0.1274
Schistosoma mansoni	serine/threonine protein kinase	0.1311	0.7569	0.7569
Echinococcus granulosus	A kinase anchor protein 10 mitochondrial	0.0277	0.1274	0.1533
Schistosoma mansoni	vesicular amine transporter	0.0079	0.0065	0.0065
Trichomonas vaginalis	conserved hypothetical protein	0.0277	0.1274	0.5
Brugia malayi	regulator of G-protein signaling rgs-7	0.0277	0.1274	0.1274
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0079	0.0065	0.0065
Echinococcus granulosus	axis inhibition protein axin	0.0277	0.1274	0.1533
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0065	0.0065
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0065	0.0065
Echinococcus granulosus	Regulator of G protein signaling 20	0.0277	0.1274	0.1533
Trichomonas vaginalis	conserved hypothetical protein	0.0277	0.1274	0.5
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0065	0.0065
Entamoeba histolytica	hypothetical protein	0.0277	0.1274	0.5
Schistosoma mansoni	Neurotrimin precursor (hNT)	0.0079	0.0065	0.0065
Schistosoma mansoni	regulator of G protein signaling	0.0277	0.1274	0.1274
Schistosoma mansoni	regulator of G protein signaling	0.0277	0.1274	0.1274
Schistosoma mansoni	regulator of G protein signaling	0.0277	0.1274	0.1274
Brugia malayi	regulator of G-protein signaling egl-10	0.0277	0.1274	0.1274
Trichomonas vaginalis	conserved hypothetical protein	0.0277	0.1274	0.5
Schistosoma mansoni	z-protein (S1r protein)	0.0277	0.1274	0.1274
Echinococcus multilocularis	Immunoglobulin	0.0079	0.0065	0.0079
Echinococcus granulosus	regulator of G protein signaling 7	0.0277	0.1274	0.1533
Schistosoma mansoni	hypothetical protein	0.0083	0.0089	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0277	0.1274	0.1274
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0065	0.0065
Schistosoma mansoni	plexin	0.0083	0.0089	0.0089
Schistosoma mansoni	serine/threonine protein kinase	0.1311	0.7569	0.7569
Echinococcus granulosus	neuroglian	0.0079	0.0065	0.0079
Echinococcus multilocularis	A kinase anchor protein 10, mitochondrial	0.0277	0.1274	0.1533
Brugia malayi	Fibronectin type III domain containing protein	0.0079	0.0065	0.0065
Echinococcus granulosus	plexin a4	0.018	0.0685	0.0824
Echinococcus multilocularis	regulator of G protein signaling 3	0.0277	0.1274	0.1533
Echinococcus multilocularis	G protein coupled receptor kinase 6	0.1433	0.8312	1
Loa Loa (eye worm)	plexin A	0.018	0.0685	0.0685
Echinococcus granulosus	regulator of G protein signaling 3	0.0277	0.1274	0.1533
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0089	0.0089
Loa Loa (eye worm)	AGC/GRK/BARK protein kinase	0.1311	0.7569	0.7569
Loa Loa (eye worm)	AGC/GRK/GRK protein kinase	0.1433	0.8312	0.8312
Schistosoma mansoni	regulator of G protein signaling 17 19 20 (rgs17 19 20)	0.0277	0.1274	0.1274
Brugia malayi	hypothetical protein	0.0277	0.1274	0.1274
Echinococcus multilocularis	regulator of G protein signaling 7	0.0277	0.1274	0.1533
Brugia malayi	Regulator of G protein signaling domain containing protein	0.0277	0.1274	0.1274
Echinococcus granulosus	beta-adrenergic receptor kinase	0.1311	0.7569	0.9106
Echinococcus multilocularis	G protein coupled receptor kinase 1	0.1034	0.5881	0.7075
Schistosoma mansoni	plexin	0.0151	0.0503	0.0503
Loa Loa (eye worm)	G protein-coupled receptor kinase 1	0.1433	0.8312	0.8312
Brugia malayi	Plexin repeat family protein	0.0151	0.0503	0.0503
Schistosoma mansoni	regulator of G protein signaling 3 rgs3	0.0277	0.1274	0.1274
Onchocerca volvulus		0.0151	0.0503	1
Echinococcus granulosus	axis inhibition protein axin	0.0277	0.1274	0.1533
Echinococcus multilocularis	Regulator of G protein signaling 20	0.0277	0.1274	0.1533
Echinococcus multilocularis	basement membrane specific heparan sulfate	0.0079	0.0065	0.0079
Loa Loa (eye worm)	hypothetical protein	0.0277	0.1274	0.1274
Echinococcus multilocularis	neuroglian	0.0079	0.0065	0.0079
Entamoeba histolytica	hypothetical protein	0.0277	0.1274	0.5
Brugia malayi	PXA domain containing protein	0.0277	0.1274	0.1274
Loa Loa (eye worm)	PXA domain-containing protein	0.0277	0.1274	0.1274
Brugia malayi	hypothetical protein	0.0277	0.1274	0.1274
Echinococcus multilocularis	Immunoglobulin	0.0079	0.0065	0.0079
Echinococcus granulosus	defective proboscis extension response	0.0079	0.0065	0.0079
Schistosoma mansoni	axis inhibition protein axin	0.0277	0.1274	0.1274
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0065	0.0065
Echinococcus granulosus	regulator of G protein signaling 3	0.0277	0.1274	0.1533
Loa Loa (eye worm)	hypothetical protein	0.0277	0.1274	0.1274
Schistosoma mansoni	regulator of G protein signaling	0.0277	0.1274	0.1274
Echinococcus granulosus	G protein coupled receptor kinase 1	0.1034	0.5881	0.7075
Loa Loa (eye worm)	hypothetical protein	0.0151	0.0503	0.0503
Echinococcus multilocularis	expressed protein	0.0277	0.1274	0.1533
Schistosoma mansoni	cell adhesion molecule	0.0079	0.0065	0.0065
Schistosoma mansoni	regulator of G protein signaling 17 19 20 (rgs17 19 20)	0.0277	0.1274	0.1274
Echinococcus granulosus	Immunoglobulin	0.0079	0.0065	0.0079
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0065	0.0065
Trichomonas vaginalis	conserved hypothetical protein	0.0277	0.1274	0.5
Echinococcus multilocularis	beta adrenergic receptor kinase	0.1311	0.7569	0.9106
Brugia malayi	PXA domain containing protein	0.0277	0.1274	0.1274
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0065	0.0065
Echinococcus granulosus	roundabout 2	0.0079	0.0065	0.0079
Echinococcus multilocularis	regulator of G protein signaling 7	0.0277	0.1274	0.1533
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0065	0.0065
Echinococcus multilocularis	axis inhibition protein axin	0.0277	0.1274	0.1533
Echinococcus granulosus	[G-protein-coupledreceptor] kinase	0.1433	0.8312	1
Echinococcus multilocularis	regulator of G protein signaling 3	0.0277	0.1274	0.1533
Brugia malayi	A-kinase anchor protein 10, precursor	0.0277	0.1274	0.1274
Entamoeba histolytica	hypothetical protein	0.0277	0.1274	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0277	0.1274	0.5
Brugia malayi	hypothetical protein	0.0079	0.0065	0.0065
Schistosoma mansoni	regulator of G protein signaling	0.0277	0.1274	0.1274
Echinococcus granulosus	regulator of G protein signaling 7	0.0277	0.1274	0.1533
Echinococcus multilocularis	axis inhibition protein axin	0.0277	0.1274	0.1533
Echinococcus multilocularis	plexin a4	0.018	0.0685	0.0824
Brugia malayi	Regulator of G protein signaling domain containing protein	0.0277	0.1274	0.1274
Trichomonas vaginalis	regulator of G protein signaling 5, rgs5, putative	0.0277	0.1274	0.5
Loa Loa (eye worm)	hypothetical protein	0.0277	0.1274	0.1274
Schistosoma mansoni	axis inhibition protein axin	0.0277	0.1274	0.1274
Loa Loa (eye worm)	hypothetical protein	0.0277	0.1274	0.1274
Brugia malayi	plexin A	0.018	0.0685	0.0685
Trichomonas vaginalis	conserved hypothetical protein	0.0277	0.1274	0.5
Brugia malayi	Probable G protein-coupled receptor kinase F19C6.1, putative	0.1433	0.8312	0.8312
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0094	0.0157	0.0157
Schistosoma mansoni	defective proboscis extension response (dpr)-related	0.0079	0.0065	0.0065
Echinococcus multilocularis	roundabout 2	0.0079	0.0065	0.0079
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0094	0.0157	0.0157
Echinococcus multilocularis	regulator of G protein signaling	0.0277	0.1274	0.1533

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: CHEMBL1766072

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 1510205