TDR Targets

Basic information

Technical information

TDR Targets ID: 759203
Name: N-(2-methylsulfanylphenyl)-2-(3-oxo-2,4-dihyd ro-1H-quinoxalin-2-yl)acetamide
MW: 327.401 | Formula: C17H17N3O2S
H donors: 3 H acceptors: 2 LogP: 2.24 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CSc1ccccc1NC(=O)CC1Nc2ccccc2NC1=O
InChi: 1S/C17H17N3O2S/c1-23-15-9-5-4-8-13(15)19-16(21)10-14-17(22)20-12-7-3-2-6-11(12)18-14/h2-9,14,18H,10H2,1H3,(H,19,21)(H,20,22)
InChiKey: VJOHTJHWHFIUAZ-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-[2-(methylthio)phenyl]-2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide
2-(3-keto-2,4-dihydro-1H-quinoxalin-2-yl)-N-[2-(methylthio)phenyl]acetamide
N-(2-methylsulfanylphenyl)-2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)ethanamide
ST5451104
CBMicro_039928
Oprea1_052928
Oprea1_269726
BIM-0039782.P001

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	regulator of G protein signaling 7	0.0009	0.0127	0.0443
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.1775	0.6915
Echinococcus granulosus	tar DNA binding protein	0.0062	0.2561	1
Brugia malayi	regulator of G-protein signaling egl-10	0.0009	0.0127	0.0146
Mycobacterium tuberculosis	Conserved protein	0.0035	0.134	0.0149
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.134	0.9696
Mycobacterium tuberculosis	Probable hydrolase	0.0035	0.134	0.0149
Schistosoma mansoni	regulator of G protein signaling	0.0009	0.0127	0.0495
Schistosoma mansoni	ras GTP exchange factor	0.0006	0.0014	0.0054
Loa Loa (eye worm)	hypothetical protein	0.0035	0.134	0.172
Mycobacterium tuberculosis	Conserved protein	0.0035	0.134	0.0149
Trichomonas vaginalis	inositol monophosphatase, putative	0.0036	0.1382	1
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.134	0.9696
Brugia malayi	RNA recognition motif domain containing protein	0.0062	0.2561	0.3303
Echinococcus multilocularis	regulator of G protein signaling 7	0.0009	0.0127	0.0443
Schistosoma mansoni	ras GTP exchange factor son of sevenless	0.0006	0.0014	0.0054
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.1382	1
Echinococcus granulosus	regulator of G protein signaling 7	0.0009	0.0127	0.0443
Echinococcus granulosus	beta LACTamase domain containing family member	0.0035	0.134	0.5209
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.134	0.9696
Schistosoma mansoni	dishevelled	0.0009	0.0127	0.0495
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.1382	1
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2561	1
Schistosoma mansoni	guanine-nucleotide-exchange-factor	0.0006	0.0014	0.0054
Onchocerca volvulus		0.0035	0.134	0.172
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0036	0.1382	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.134	0.172
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0035	0.134	0.0149
Mycobacterium tuberculosis	Probable lipase LipE	0.0035	0.134	0.0149
Echinococcus multilocularis	inositol monophosphatase 1	0.0036	0.1382	0.5372
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0127	0.0146
Toxoplasma gondii	ABC1 family protein	0.0035	0.134	0.9669
Mycobacterium leprae	Probable lipase LipE	0.0035	0.134	1
Schistosoma mansoni	inositol monophosphatase	0.0036	0.1382	0.5397
Schistosoma mansoni	ras GTP exchange factor son of sevenless	0.0006	0.0014	0.0054
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.1775	0.6915
Brugia malayi	beta-lactamase family protein	0.0035	0.134	0.172
Mycobacterium tuberculosis	Conserved protein	0.0035	0.134	0.0149
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0035	0.134	0.172
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.1775	0.6932
Echinococcus multilocularis	tar DNA binding protein	0.0062	0.2561	1
Mycobacterium leprae	conserved hypothetical protein	0.0035	0.134	1
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.134	0.9696
Brugia malayi	RNA binding protein	0.0062	0.2561	0.3303
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2561	1
Loa Loa (eye worm)	beta-lactamase	0.0035	0.134	0.172
Brugia malayi	beta-lactamase family protein	0.0035	0.134	0.172
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.134	0.5234
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.134	0.9696
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.1775	0.2284
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.1382	1
Schistosoma mansoni	dep domain containing protein	0.0009	0.0127	0.0495
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0036	0.1382	1
Brugia malayi	hypothetical protein	0.0009	0.0127	0.0146
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0062	0.2561	0.3303
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0035	0.134	0.0149
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0127	0.0146
Brugia malayi	beta-lactamase	0.0035	0.134	0.172
Trichomonas vaginalis	esterase, putative	0.0035	0.134	0.9696
Loa Loa (eye worm)	hypothetical protein	0.0035	0.134	0.172
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.134	0.5234
Schistosoma mansoni	dishevelled	0.0009	0.0127	0.0495
Loa Loa (eye worm)	TAR-binding protein	0.0062	0.2561	0.3303
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0036	0.1382	1
Schistosoma mansoni	ras GTP exchange factor son of sevenless	0.0006	0.0014	0.0054
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2561	1
Loa Loa (eye worm)	inositol-1	0.0036	0.1382	0.1774
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.1775	0.6915
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.1382	1
Onchocerca volvulus		0.0035	0.134	0.172
Echinococcus granulosus	segment polarity protein dishevelled	0.0009	0.0127	0.0443
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.1775	0.6932
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0035	0.134	0.0149
Mycobacterium tuberculosis	Probable lipase LipD	0.0035	0.134	0.0149
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0035	0.134	0.172
Echinococcus granulosus	Pleckstrin G protein interacting region	0.0009	0.0127	0.0443
Brugia malayi	Inositol-1	0.0036	0.1382	0.1774
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.1775	0.6915
Schistosoma mansoni	z-protein (S1r protein)	0.0009	0.0127	0.0495
Onchocerca volvulus		0.0035	0.134	0.172
Loa Loa (eye worm)	G protein signaling regulator EGL-10	0.0009	0.0127	0.0146
Schistosoma mansoni	inositol monophosphatase	0.0036	0.1382	0.5397
Onchocerca volvulus	Rap guanine nucleotide exchange factor 1 homolog	0.0175	0.7725	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.134	0.172
Plasmodium vivax	hypothetical protein, conserved	0.0035	0.134	0.5
Echinococcus multilocularis	segment polarity protein dishevelled	0.0009	0.0127	0.0443
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.1382	1
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0127	0.0146
Mycobacterium tuberculosis	Probable esterase LipL	0.0035	0.134	0.0149
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.1775	0.6932
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0036	0.1382	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2561	1
Brugia malayi	DIX domain containing protein	0.0009	0.0127	0.0146
Onchocerca volvulus	Segment polarity protein dishevelled homolog	0.0009	0.0127	0.0146
Echinococcus multilocularis	segment polarity protein dishevelled	0.0009	0.0127	0.0443
Echinococcus multilocularis	Pleckstrin G protein, interacting region	0.0009	0.0127	0.0443
Brugia malayi	N-terminal motif family protein	0.0175	0.7725	1
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0035	0.134	0.5209
Brugia malayi	TAR-binding protein	0.0062	0.2561	0.3303
Echinococcus granulosus	segment polarity protein dishevelled	0.0009	0.0127	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0175	0.7725	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.134	0.172
Echinococcus granulosus	inositol monophosphatase 1	0.0036	0.1382	0.5372
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.134	0.9696
Echinococcus multilocularis	regulator of G protein signaling 7	0.0009	0.0127	0.0443
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.1775	0.2284
Schistosoma mansoni	fyve finger-containing phosphoinositide kinase fyv1	0.0009	0.0127	0.0495
Schistosoma mansoni	tar DNA-binding protein	0.0062	0.2561	1
Loa Loa (eye worm)	RNA binding protein	0.0062	0.2561	0.3303
Brugia malayi	hypothetical protein	0.0009	0.0127	0.0146
Loa Loa (eye worm)	DIX domain-containing protein	0.0009	0.0127	0.0146
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.1382	1
Onchocerca volvulus		0.0009	0.0127	0.0146
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.134	0.9696
Loa Loa (eye worm)	hypothetical protein	0.0035	0.134	0.172
Brugia malayi	Domain found in Dishevelled, Egl-10, and Pleckstrin family protein	0.0009	0.0127	0.0146
Brugia malayi	Domain found in Dishevelled, Egl-10, and Pleckstrin family protein	0.0009	0.0127	0.0146

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 759203