TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 242.724 | Formula: C7H15ClN2O3S
H donors: 2 H acceptors: 2 LogP: 0.67 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)C(CSC(=O)NC)N.Cl
InChi: 1S/C7H14N2O3S.ClH/c1-3-12-6(10)5(8)4-13-7(11)9-2;/h5H,3-4,8H2,1-2H3,(H,9,11);1H
InChiKey: LYLDPAYWSCPRTI-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
Brugia malayi	Protein kinase domain containing protein	0.0482	0.304	0.304
Plasmodium falciparum	calcium-dependent protein kinase 7	0.0103	0.0446	0.0123
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Loa Loa (eye worm)	AGC/NDR protein kinase	0.0482	0.304	0.304
Onchocerca volvulus	Putative zinc finger protein	0.0092	0.0375	0.5
Echinococcus multilocularis	serine:threonine protein kinase 38	0.0482	0.304	0.4166
Trypanosoma cruzi	Protein kinase B	0.1027	0.6773	1
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Schistosoma mansoni	dynamin	0.0092	0.0375	0.0553
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.1027	0.6773	1
Leishmania major	serine/threonine-protein kinase a, putative	0.0103	0.0446	1
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Echinococcus multilocularis	nervana 2	0.0924	0.6068	0.8899
Loa Loa (eye worm)	rho-GTPase-activating	0.0092	0.0375	0.0375
Brugia malayi	Oxysterol-binding protein	0.0092	0.0375	0.0375
Schistosoma mansoni	serine/threonine kinase	0.0482	0.304	0.4488
Trypanosoma cruzi	NEK family Serine/threonine-protein kinase, putative	0.0103	0.0446	0.0111
Trichomonas vaginalis	AGC family protein kinase	0.1498	1	1
Trichomonas vaginalis	AGC family protein kinase	0.0574	0.3673	0.3427
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0055	0.012	0.012
Plasmodium falciparum	RAC-beta serine/threonine protein kinase	0.0934	0.6139	1
Schistosoma mansoni	phosphoinositol 4-phosphate adaptor protein	0.0092	0.0375	0.0553
Onchocerca volvulus	Abnormal cell migration protein 10 homolog	0.0092	0.0375	0.5
Trypanosoma brucei	serine/threonine-protein kinase NRKB, putative	0.0103	0.0446	0.0074
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.0482	0.304	0.4166
Plasmodium vivax	rac-beta serine/threonine protein kinase, putative	0.0934	0.6139	1
Schistosoma mansoni	serine/threonine protein kinase	0.0482	0.304	0.4488
Trypanosoma cruzi	NIMA-related kinase, putative	0.0103	0.0446	0.0111
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.0934	0.6139	0.901
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Schistosoma mansoni	myotubularin-related protein	0.0092	0.0375	0.0553
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Trichomonas vaginalis	AGC family protein kinase	0.1498	1	1
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0103	0.0446	0.0111
Trypanosoma brucei	protein kinase, putative	0.0103	0.0446	0.0074
Entamoeba histolytica	protein kinase, putative	0.0103	0.0446	0.0074
Entamoeba histolytica	protein kinase, putative	0.0103	0.0446	0.0074
Loa Loa (eye worm)	AGC/PKN protein kinase	0.0482	0.304	0.304
Brugia malayi	TBC domain containing protein	0.0092	0.0375	0.0375
Entamoeba histolytica	protein kinase, putative	0.0103	0.0446	0.0074
Schistosoma mansoni	hypothetical protein	0.0092	0.0375	0.0553
Schistosoma mansoni	zinc finger protein	0.0092	0.0375	0.0553
Brugia malayi	Dynamin	0.0092	0.0375	0.0375
Trypanosoma brucei	serine/threonine-protein kinase NrkA	0.0103	0.0446	0.0074
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	0.0924	0.6068	0.8899
Onchocerca volvulus		0.0092	0.0375	0.5
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.0482	0.304	0.304
Trypanosoma cruzi	serine/threonine protein kinase, putative	0.0103	0.0446	0.0111
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0934	0.6139	0.901
Trypanosoma brucei	NEK family Serine/threonine-protein kinase, putative	0.0103	0.0446	0.0074
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Brugia malayi	Hr1 repeat family protein	0.0482	0.304	0.304
Echinococcus granulosus	protein kinase c iota type	0.0482	0.304	0.4166
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Schistosoma mansoni	serine/threonine protein kinase	0.0482	0.304	0.4488
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Leishmania major	folate/biopterin transporter, putative	0.0103	0.0446	1
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.0482	0.304	0.4166
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.0482	0.304	0.4166
Trypanosoma cruzi	Serine/threonine-protein kinase NEK17, putative	0.0103	0.0446	0.0111
Onchocerca volvulus	Protein melted homolog	0.0092	0.0375	0.5
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.0482	0.304	0.304
Trichomonas vaginalis	3-phosphoinositide dependent protein kinase-1, putative	0.0103	0.0446	0.0074
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.0482	0.304	0.4166
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Brugia malayi	Syntrophin-1	0.0092	0.0375	0.0375
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.0934	0.6139	0.901
Brugia malayi	PH domain containing protein	0.0092	0.0375	0.0375
Leishmania major	rac serine-threonine kinase, putative,protein kinase, putative	0.0103	0.0446	1
Brugia malayi	GTP-ase activating protein for Arf containing protein	0.0092	0.0375	0.0375
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.0482	0.304	0.304
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Toxoplasma gondii	AGC kinase	0.1406	0.9367	1
Brugia malayi	Variant SH3 domain containing protein	0.0092	0.0375	0.0375
Trichomonas vaginalis	AGC family protein kinase	0.1498	1	1
Brugia malayi	GTP-ase activating protein for Arf containing protein	0.0092	0.0375	0.0375
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Schistosoma mansoni	hypothetical protein	0.0092	0.0375	0.0553
Loa Loa (eye worm)	uncoordinated protein 104	0.0092	0.0375	0.0375
Brugia malayi	Pleckstrin Homology Domain	0.0092	0.0375	0.0375
Trichomonas vaginalis	AGC family protein kinase	0.1498	1	1
Echinococcus multilocularis	serine threonine protein kinase	0.0482	0.304	0.4166
Echinococcus multilocularis	protein kinase c iota type	0.0482	0.304	0.4166
Loa Loa (eye worm)	GTP-ase activating protein for Arf containing protein	0.0092	0.0375	0.0375
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.0482	0.304	0.4166
Onchocerca volvulus		0.0092	0.0375	0.5
Echinococcus granulosus	nervana 2	0.0924	0.6068	0.8899
Entamoeba histolytica	PH domain containing protein kinase, putative	0.1027	0.6773	0.6647
Trypanosoma brucei	Serine/threonine-protein kinase NEK21, putative	0.0103	0.0446	0.0074
Echinococcus granulosus	Glutaredoxin protein 5	0.0924	0.6068	0.8899
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0482	0.304	0.4166
Brugia malayi	MAX-1A	0.0092	0.0375	0.0375
Loa Loa (eye worm)	PH domain-containing protein	0.0092	0.0375	0.0375
Schistosoma mansoni	syntrophin	0.0092	0.0375	0.0553
Echinococcus granulosus	Protein kinase C brain isozyme	0.0482	0.304	0.4166
Schistosoma mansoni	serine/threonine protein kinase	0.0482	0.304	0.4488
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Onchocerca volvulus		0.0092	0.0375	0.5
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	0.0924	0.6068	0.8899
Schistosoma mansoni	goodpasture antigen-binding protein	0.0092	0.0375	0.0553
Trypanosoma brucei	rac serine-threonine kinase, putative	0.1498	1	1
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Brugia malayi	Cadps2 protein	0.0092	0.0375	0.0375
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Echinococcus multilocularis	protein kinase c epsilon type	0.0482	0.304	0.4166
Schistosoma mansoni	serine/threonine protein kinase	0.0482	0.304	0.4488
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0055	0.012	0.012
Schistosoma mansoni	serine/threonine protein kinase	0.0482	0.304	0.4488
Brugia malayi	GTPase-activator protein for Ras-like GTPase containing protein	0.0092	0.0375	0.0375
Schistosoma mansoni	hypothetical protein	0.0092	0.0375	0.0553
Brugia malayi	probable spectrin beta chain	0.0092	0.0375	0.0375
Echinococcus granulosus	protein kinase C gamma type	0.0482	0.304	0.4166
Schistosoma mansoni	centaurin alpha	0.0092	0.0375	0.0553
Onchocerca volvulus	Putative neuronal RhoA GEF protein	0.0092	0.0375	0.5
Schistosoma mansoni	dynamin	0.0092	0.0375	0.0553
Onchocerca volvulus	outspread protein homolog	0.0092	0.0375	0.5
Echinococcus granulosus	serine threonine protein kinase nrc	0.0934	0.6139	0.901
Entamoeba histolytica	protein kinase 2, putative	0.0934	0.6139	0.5989
Brugia malayi	Dynamin	0.0092	0.0375	0.0375
Brugia malayi	PH domain containing protein	0.0092	0.0375	0.0375
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.1406	0.9367	0.9367
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0103	0.0446	0.0074
Schistosoma mansoni	serine/threonine protein kinase	0.0482	0.304	0.4488
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Brugia malayi	PH domain containing protein	0.0092	0.0375	0.0375
Schistosoma mansoni	serine/threonine-protein kinase	0.1027	0.6773	1
Onchocerca volvulus		0.0092	0.0375	0.5
Entamoeba histolytica	hypothetical protein	0.0103	0.0446	0.0074
Loa Loa (eye worm)	Plekhf2 protein	0.0092	0.0375	0.0375
Trichomonas vaginalis	AGC family protein kinase	0.1498	1	1
Trichomonas vaginalis	AGC family protein kinase	0.0482	0.304	0.2769
Trypanosoma cruzi	serine/threonine-protein kinase NRKB, putative	0.0103	0.0446	0.0111
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0103	0.0446	0.0074
Brugia malayi	PH domain containing protein	0.0092	0.0375	0.0375
Schistosoma mansoni	hypothetical protein	0.0092	0.0375	0.0553
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Trypanosoma cruzi	NIMA-related kinase, putative	0.0103	0.0446	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Trypanosoma cruzi	Serine/threonine-protein kinase NEK21, putative	0.0103	0.0446	0.0111
Loa Loa (eye worm)	cytohesin 3	0.0092	0.0375	0.0375
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Schistosoma mansoni	growth factor receptor-bound protein	0.0092	0.0375	0.0553
Schistosoma mansoni	rho gtpase activating protein	0.0092	0.0375	0.0553
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Schistosoma mansoni	serine/threonine-protein kinase	0.1027	0.6773	1
Onchocerca volvulus		0.0092	0.0375	0.5
Trichomonas vaginalis	AGC family protein kinase	0.1498	1	1
Leishmania major	protein kinase, putative	0.0103	0.0446	1
Schistosoma mansoni	hypothetical protein	0.0092	0.0375	0.0553
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Trichomonas vaginalis	ribosomal protein S6 kinase, 90kD, polypeptide, putative	0.0103	0.0446	0.0074
Brugia malayi	hypothetical protein	0.0092	0.0375	0.0375
Leishmania major	protein kinase, putative	0.0103	0.0446	1
Trichomonas vaginalis	AGC family protein kinase	0.1498	1	1
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.0482	0.304	0.4166
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Toxoplasma gondii	protein kinase domain-containing protein	0.0103	0.0446	0.0079
Schistosoma mansoni	rhogef and pleckstrin domain protein	0.0092	0.0375	0.0553
Trichomonas vaginalis	AGC family protein kinase	0.0482	0.304	0.2769
Loa Loa (eye worm)	GTP-ase activating protein for Arf containing protein	0.0092	0.0375	0.0375
Entamoeba histolytica	protein kinase, putative	0.0103	0.0446	0.0074
Schistosoma mansoni	vav2	0.0092	0.0375	0.0553
Plasmodium vivax	calcium-dependent protein kinase 7, putative	0.0103	0.0446	0.0123
Brugia malayi	PH domain containing protein	0.0092	0.0375	0.0375
Brugia malayi	p70 ribosomal S6 kinase beta	0.1406	0.9367	0.9367
Entamoeba histolytica	protein kinase, putative	0.1498	1	1
Trypanosoma cruzi	Serine/threonine-protein kinase NEK17, putative	0.0103	0.0446	0.0111
Echinococcus granulosus	nervana 2	0.0924	0.6068	0.8899
Echinococcus multilocularis	rac serine:threonine kinase	0.1027	0.6773	1
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0103	0.0446	0.0074
Echinococcus granulosus	serine:threonine protein kinase N2	0.0482	0.304	0.4166
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Brugia malayi	Plekhf2 protein	0.0092	0.0375	0.0375
Brugia malayi	PH domain containing protein	0.0092	0.0375	0.0375
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Onchocerca volvulus		0.0092	0.0375	0.5
Schistosoma mansoni	oxysterol-binding protein 1	0.0092	0.0375	0.0553
Brugia malayi	PH domain containing protein	0.0092	0.0375	0.0375
Loa Loa (eye worm)	hypothetical protein	0.0055	0.012	0.012
Entamoeba histolytica	protein kinase, putative	0.1498	1	1
Onchocerca volvulus		0.0092	0.0375	0.5
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Schistosoma mansoni	atypical protein kinase C	0.0482	0.304	0.4488
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Schistosoma mansoni	oxysterol-binding protein 1	0.0092	0.0375	0.0553
Entamoeba histolytica	protein kinase, putative	0.1406	0.9367	0.9342
Schistosoma mansoni	zinc finger protein	0.0092	0.0375	0.0553
Echinococcus granulosus	NDR protein kinase	0.0482	0.304	0.4166
Trichomonas vaginalis	serine/threonine-protein kinase sgk, putative	0.0471	0.2969	0.2695
Echinococcus multilocularis	Glutaredoxin protein 5	0.0924	0.6068	0.8899
Echinococcus granulosus	protein kinase c epsilon type	0.0482	0.304	0.4166
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0055	0.012	0.012
Trichomonas vaginalis	AGC family protein kinase	0.0103	0.0446	0.0074
Echinococcus multilocularis	serine:threonine protein kinase N2	0.0482	0.304	0.4166
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Brugia malayi	PH domain containing protein	0.0092	0.0375	0.0375
Brugia malayi	Uncoordinated protein 104	0.0092	0.0375	0.0375
Schistosoma mansoni	goodpasture antigen-binding protein	0.0092	0.0375	0.0553
Loa Loa (eye worm)	RhoGEF domain-containing protein	0.0092	0.0375	0.0375
Entamoeba histolytica	hypothetical protein	0.0103	0.0446	0.0074
Giardia lamblia	Kinase, AGC PKA	0.0934	0.6139	0.5
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Schistosoma mansoni	development and differentiation-enhancing factor ddef	0.0092	0.0375	0.0553
Brugia malayi	Cytohesin 3	0.0092	0.0375	0.0375
Trichomonas vaginalis	AGC family protein kinase	0.0482	0.304	0.2769
Brugia malayi	protein kinase C II.	0.0482	0.304	0.304
Echinococcus granulosus	serine/threonine protein kinase	0.1027	0.6773	1
Loa Loa (eye worm)	oxysterol binding protein	0.0092	0.0375	0.0375
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0375	0.0375
Leishmania major	protein kinase, putative,serine/threonine protein kinase, putative	0.0103	0.0446	1
Brugia malayi	Protein kinase domain containing protein	0.0482	0.304	0.304
Trypanosoma cruzi	Serine/threonine-protein kinase NEK21, putative	0.0103	0.0446	0.0111
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.0482	0.304	0.4166
Entamoeba histolytica	protein kinase, putative	0.0103	0.0446	0.0074
Schistosoma mansoni	serine/threonine protein kinase	0.0482	0.304	0.4488
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.0482	0.304	0.304
Brugia malayi	PH domain containing protein	0.0092	0.0375	0.0375
Toxoplasma gondii	calcium dependent protein kinase CDPK7	0.0103	0.0446	0.0079
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.0092	0.0375	0.0375
Echinococcus multilocularis	nervana 2	0.0924	0.6068	0.8899
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0103	0.0446	0.0074
Entamoeba histolytica	p21-activated kinase	0.0103	0.0446	0.0074
Entamoeba histolytica	protein kinase, putative	0.0482	0.304	0.2769
Brugia malayi	Oxysterol binding protein	0.0092	0.0375	0.0375
Brugia malayi	Variant SH3 domain containing protein	0.0092	0.0375	0.0375
Loa Loa (eye worm)	hypothetical protein	0.0482	0.304	0.304
Entamoeba histolytica	PH domain containing protein kinase, putative	0.1027	0.6773	0.6647
Loa Loa (eye worm)	AGC/AKT protein kinase	0.1498	1	1
Schistosoma mansoni	guanyl-nucleotide exchange factor	0.0092	0.0375	0.0553
Loa Loa (eye worm)	syntrophin-1	0.0092	0.0375	0.0375

Activities

Activity type	Activity value	Assay description	Source	Reference
GI50 (functional)	-4.522	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the P388 Leukemia cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.145	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.131	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.078	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4.007	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-3.952	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-3.735	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-3.586	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-3.572	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory)	ChEMBL.	No reference

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: CHEMBL1997812

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1628183