TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 918.208 | Formula: C53H79N3O10
H donors: 4 H acceptors: 9 LogP: 8.76 Rotable bonds: 5
Rule of 5 violations (Lipinski): 2
SMILES: CC[C@H]1/C=C/C=C/C[C@@H](C)[C@H](O)[C@@](C)(O)C(=O)[C@@H](C)[C@H](O)[C@@H](C)C(=O)[C@H]([C@@H]([C@H](/C=C/C(=O)O[C@@H]2[C@@H]([C@H](CC1)O[C@]1(CC[C@@H]([C@@H](O1)C[C@@H](n1nnc(c1)c1ccccc1)C)C)[C@H]2C)C)C)O)C
InChi: 1S/C53H79N3O10/c1-12-40-20-16-13-15-19-33(4)50(61)52(11,63)51(62)38(9)48(60)37(8)47(59)36(7)46(58)32(3)23-26-45(57)64-49-35(6)43(25-24-40)65-53(39(49)10)28-27-31(2)44(66-53)29-34(5)56-30-42(54-55-56)41-21-17-14-18-22-41/h13-18,20-23,26,30-40,43-44,46,48-50,58,60-61,63H,12,19,24-25,27-29H2,1-11H3/b15-13+,20-16+,26-23+/t31-,32-,33+,34-,35+,36-,37-,38-,39-,40-,43-,44-,46+,48+,49+,50-,52+,53-/m0/s1
InChiKey: RHQHRLHWKVVTFW-DRKLDTCNSA-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	serine threonine protein kinase nrc	0.6504	0.6436	0.959
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 3	0.0166	0.0082	0.0122
Entamoeba histolytica	protein kinase 2, putative	0.6504	0.6436	0.6366
Echinococcus multilocularis	Oxysterol binding protein 11	0.0275	0.0191	0.0284
Schistosoma mansoni	guanyl-nucleotide exchange factor	0.0275	0.0191	0.0284
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Schistosoma mansoni	serine/threonine protein kinase	0.3353	0.3277	0.4883
Echinococcus granulosus	beta 1 syntrophin	0.0275	0.0191	0.0284
Onchocerca volvulus		0.0275	0.0191	0.5
Echinococcus granulosus	Pleckstrin domain containing protein family B	0.0275	0.0191	0.0284
Schistosoma mansoni	goodpasture antigen-binding protein	0.0275	0.0191	0.0284
Echinococcus granulosus	protein kinase c iota type	0.3353	0.3277	0.4883
Entamoeba histolytica	protein kinase, putative	0.9785	0.9725	0.9719
Echinococcus granulosus	Pleckstrin y	0.0275	0.0191	0.0284
Plasmodium vivax	calcium-dependent protein kinase 7, putative	0.0347	0.0263	0.0116
Onchocerca volvulus	Putative neuronal RhoA GEF protein	0.0275	0.0191	0.5
Entamoeba histolytica	PH domain containing protein kinase, putative	0.6779	0.6711	0.6647
Echinococcus multilocularis	Protein kinase C, brain isozyme	0.3353	0.3277	0.4883
Trypanosoma cruzi	Serine/threonine-protein kinase NEK21, putative	0.0347	0.0263	0.0111
Mycobacterium tuberculosis	Probable glutamine-binding lipoprotein GlnH (GLNBP)	0.0088	0.0004	0.5
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Echinococcus multilocularis	DCC interacting protein 13 beta	0.0275	0.0191	0.0284
Schistosoma mansoni	atypical protein kinase C	0.3353	0.3277	0.4883
Trichomonas vaginalis	AGC family protein kinase	1.006	1	1
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	0.6432	0.6363	0.9481
Schistosoma mansoni	serine/threonine protein kinase	0.3353	0.3277	0.4883
Brugia malayi	Hr1 repeat family protein	0.3353	0.3277	0.3146
Schistosoma mansoni	hypothetical protein	0.0275	0.0191	0.0284
Entamoeba histolytica	PH domain containing protein kinase, putative	0.6779	0.6711	0.6647
Trichomonas vaginalis	AGC family protein kinase	1.006	1	1
Echinococcus granulosus	protein kinase c epsilon type	0.3353	0.3277	0.4883
Entamoeba histolytica	protein kinase, putative	0.0347	0.0263	0.0074
Echinococcus granulosus	ribosomal protein S6 kinase alpha 3	0.3353	0.3277	0.4883
Echinococcus granulosus	DCC interacting protein 13 beta	0.0275	0.0191	0.0284
Echinococcus multilocularis	cytohesin 1	0.0275	0.0191	0.0284
Echinococcus multilocularis	oxysterol binding protein 1	0.0275	0.0191	0.0284
Schistosoma mansoni	dynamin	0.0275	0.0191	0.0284
Trichomonas vaginalis	AGC family protein kinase	1.006	1	1
Loa Loa (eye worm)	AGC/RSK/RSK protein kinase	0.3353	0.3277	0.3146
Echinococcus granulosus	collagen type iv alpha 3 binding protein	0.0275	0.0191	0.0284
Trichomonas vaginalis	ribosomal protein S6 kinase, 90kD, polypeptide, putative	0.0347	0.0263	0.0074
Onchocerca volvulus		0.0275	0.0191	0.5
Brugia malayi	p70 ribosomal S6 kinase beta	0.9785	0.9725	0.9719
Trypanosoma cruzi	NIMA-related kinase, putative	0.0347	0.0263	0.0111
Echinococcus granulosus	protein kinase C gamma type	0.3353	0.3277	0.4883
Loa Loa (eye worm)	AGC/RSK/MSK protein kinase	0.3353	0.3277	0.3146
Echinococcus multilocularis	pdz domain containing protein	0.0275	0.0191	0.0284
Echinococcus granulosus	arf GAP with coiled coil ANK repeat and PH	0.0275	0.0191	0.0284
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.0118	0.0034	0.005
Echinococcus granulosus	pdz domain containing protein	0.0275	0.0191	0.0284
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0347	0.0263	0.0111
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0347	0.0263	0.0074
Brugia malayi	Protein kinase domain containing protein	0.3353	0.3277	0.3146
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.0118	0.0034	0.005
Echinococcus multilocularis	rac serine:threonine kinase	0.6779	0.6711	1
Echinococcus granulosus	oxysterol binding protein 1	0.0275	0.0191	0.0284
Echinococcus multilocularis	beta 1 syntrophin	0.0275	0.0191	0.0284
Onchocerca volvulus	Protein melted homolog	0.0275	0.0191	0.5
Trypanosoma cruzi	NIMA-related kinase, putative	0.0347	0.0263	0.0111
Echinococcus multilocularis	serine:threonine protein kinase 38	0.3353	0.3277	0.4883
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Schistosoma mansoni	myotubularin-related protein	0.0275	0.0191	0.0284
Echinococcus multilocularis	ras specific guanine nucleotide releasing factor	0.0275	0.0191	0.0284
Leishmania major	folate/biopterin transporter, putative	0.0347	0.0263	1
Schistosoma mansoni	zinc finger protein	0.0275	0.0191	0.0284
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Schistosoma mansoni	serine/threonine kinase	0.3353	0.3277	0.4883
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0347	0.0263	0.0074
Echinococcus multilocularis	actin binding protein anillin	0.0275	0.0191	0.0284
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Echinococcus multilocularis	oxysterol binding protein 9	0.0275	0.0191	0.0284
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0347	0.0263	0.0074
Echinococcus granulosus	nervana 2	0.6432	0.6363	0.9481
Schistosoma mansoni	growth factor receptor-bound protein	0.0275	0.0191	0.0284
Trypanosoma brucei	protein kinase, putative	0.0347	0.0263	0.0074
Trypanosoma cruzi	Serine/threonine-protein kinase NEK21, putative	0.0347	0.0263	0.0111
Trichomonas vaginalis	AGC family protein kinase	0.3628	0.3552	0.3427
Mycobacterium ulcerans	glutamine-binding lipoprotein GlnH	0.0088	0.0004	0.5
Echinococcus multilocularis	ribosomal protein S6 kinase alpha 3	0.3353	0.3277	0.4883
Echinococcus granulosus	Oxysterol binding protein 11	0.0275	0.0191	0.0284
Echinococcus granulosus	Protein kinase C brain isozyme	0.3353	0.3277	0.4883
Trichomonas vaginalis	AGC family protein kinase	0.3353	0.3277	0.3146
Echinococcus multilocularis	FERM and pleckstrin domain containing protein	0.0275	0.0191	0.0284
Echinococcus multilocularis	Rho GTPase activating protein 24	0.0275	0.0191	0.0284
Entamoeba histolytica	protein kinase, putative	0.0347	0.0263	0.0074
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0347	0.0263	0.0074
Chlamydia trachomatis	arginine ABC transporter substrate-binding protein ArtJ	0.0088	0.0004	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.3353	0.3277	0.4883
Schistosoma mansoni	vav2	0.0275	0.0191	0.0284
Trichomonas vaginalis	AGC family protein kinase	0.3353	0.3277	0.3146
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Trichomonas vaginalis	serine/threonine-protein kinase sgk, putative	0.3281	0.3204	0.3072
Echinococcus multilocularis	protein kinase c iota type	0.3353	0.3277	0.4883
Loa Loa (eye worm)	AGC/PKC/ETA protein kinase	0.3353	0.3277	0.3146
Schistosoma mansoni	serine/threonine protein kinase	0.3353	0.3277	0.4883
Schistosoma mansoni	hypothetical protein	0.0275	0.0191	0.0284
Schistosoma mansoni	goodpasture antigen-binding protein	0.0275	0.0191	0.0284
Trichomonas vaginalis	AGC family protein kinase	1.006	1	1
Echinococcus granulosus	NDR protein kinase	0.3353	0.3277	0.4883
Trichomonas vaginalis	AGC family protein kinase	1.006	1	1
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.0118	0.0034	0.005
Entamoeba histolytica	protein kinase, putative	0.0347	0.0263	0.0074
Echinococcus granulosus	Rho GTPase activating protein 24	0.0275	0.0191	0.0284
Entamoeba histolytica	protein kinase, putative	0.3353	0.3277	0.3146
Entamoeba histolytica	protein kinase, putative	0.0347	0.0263	0.0074
Trichomonas vaginalis	AGC family protein kinase	1.006	1	1
Onchocerca volvulus	Abnormal cell migration protein 10 homolog	0.0275	0.0191	0.5
Leishmania major	protein kinase, putative	0.0347	0.0263	1
Echinococcus multilocularis	calcium dependent secretion activator 1	0.0275	0.0191	0.0284
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.6504	0.6436	0.959
Trypanosoma brucei	NEK family Serine/threonine-protein kinase, putative	0.0347	0.0263	0.0074
Echinococcus granulosus	myotubularin protein 13	0.0275	0.0191	0.0284
Echinococcus multilocularis	collagen type iv alpha 3 binding protein	0.0275	0.0191	0.0284
Echinococcus multilocularis	serine threonine protein kinase	0.3353	0.3277	0.4883
Schistosoma mansoni	oxysterol-binding protein 1	0.0275	0.0191	0.0284
Echinococcus granulosus	serine/threonine protein kinase	0.6779	0.6711	1
Entamoeba histolytica	protein kinase, putative	1.006	1	1
Echinococcus granulosus	nervana 2	0.6432	0.6363	0.9481
Echinococcus granulosus	pleckstrin y domain containing family A	0.0275	0.0191	0.0284
Echinococcus multilocularis	nervana 2	0.6432	0.6363	0.9481
Leishmania major	protein kinase, putative	0.0347	0.0263	1
Trichomonas vaginalis	AGC family protein kinase	0.3353	0.3277	0.3146
Toxoplasma gondii	AGC kinase	0.9785	0.9725	1
Onchocerca volvulus		0.0275	0.0191	0.5
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Schistosoma mansoni	hypothetical protein	0.0275	0.0191	0.0284
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.0118	0.0034	0.005
Echinococcus granulosus	Arf GAP and Pleckstrin domain containing protein	0.0275	0.0191	0.0284
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.6504	0.6436	0.9578
Trypanosoma cruzi	NEK family Serine/threonine-protein kinase, putative	0.0347	0.0263	0.0111
Leishmania major	rac serine-threonine kinase, putative,protein kinase, putative	0.0347	0.0263	1
Trypanosoma cruzi	serine/threonine protein kinase, putative	0.0347	0.0263	0.0111
Onchocerca volvulus	Putative zinc finger protein	0.0275	0.0191	0.5
Schistosoma mansoni	serine/threonine protein kinase	0.3353	0.3277	0.4883
Trypanosoma brucei	serine/threonine-protein kinase NrkA	0.0347	0.0263	0.0074
Echinococcus multilocularis	Ribosomal protein S6 kinase beta 2	0.3353	0.3277	0.4883
Loa Loa (eye worm)	AGC/PKN protein kinase	0.3353	0.3277	0.3146
Echinococcus multilocularis	serine:threonine protein kinase N2	0.3353	0.3277	0.4883
Echinococcus multilocularis	Pleckstrin y	0.0275	0.0191	0.0284
Schistosoma mansoni	oxysterol-binding protein 1	0.0275	0.0191	0.0284
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.6779	0.6711	1
Echinococcus multilocularis	type II inositol 3,4 bisphosphate 4 phosphatase	0.0275	0.0191	0.0284
Echinococcus multilocularis	pleckstrin y domain containing family A	0.0275	0.0191	0.0284
Echinococcus granulosus	Pleckstrin y	0.0275	0.0191	0.0284
Echinococcus multilocularis	protein kinase c epsilon type	0.3353	0.3277	0.4883
Echinococcus multilocularis	Ras associated and pleckstrin y	0.0275	0.0191	0.0284
Loa Loa (eye worm)	AGC/NDR protein kinase	0.3353	0.3277	0.3146
Onchocerca volvulus		0.0275	0.0191	0.5
Onchocerca volvulus		0.0275	0.0191	0.5
Treponema pallidum	amino acid ABC transporter, periplasmic binding protein	0.0088	0.0004	0.5
Brugia malayi	protein kinase C II.	0.3353	0.3277	0.3146
Echinococcus multilocularis	Arf GAP and Pleckstrin domain containing protein	0.0275	0.0191	0.0284
Leishmania major	protein kinase, putative,serine/threonine protein kinase, putative	0.0347	0.0263	1
Loa Loa (eye worm)	AGC/AKT protein kinase	1.006	1	1
Entamoeba histolytica	protein kinase, putative	0.0347	0.0263	0.0074
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Schistosoma mansoni	serine/threonine protein kinase	0.3353	0.3277	0.4883
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Onchocerca volvulus		0.0275	0.0191	0.5
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.0118	0.0034	0.005
Echinococcus multilocularis	serine:threonine protein kinase N2	0.3353	0.3277	0.4883
Schistosoma mansoni	zinc finger protein	0.0275	0.0191	0.0284
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.6504	0.6436	0.959
Entamoeba histolytica	protein kinase, putative	1.006	1	1
Schistosoma mansoni	phosphoinositol 4-phosphate adaptor protein	0.0275	0.0191	0.0284
Echinococcus multilocularis	arf GAP with SH3 domain, ANK repeat and PH	0.0275	0.0191	0.0284
Trypanosoma cruzi	Protein kinase B	0.6779	0.6711	1
Plasmodium vivax	rac-beta serine/threonine protein kinase, putative	0.6504	0.6436	1
Echinococcus granulosus	FERM and pleckstrin domain containing protein	0.0275	0.0191	0.0284
Trypanosoma brucei	rac serine-threonine kinase, putative	1.006	1	1
Schistosoma mansoni	dynamin	0.0275	0.0191	0.0284
Entamoeba histolytica	hypothetical protein	0.0347	0.0263	0.0074
Echinococcus multilocularis	ribosomal protein s6 kinase beta 1	0.3353	0.3277	0.4883
Trypanosoma brucei	Serine/threonine-protein kinase NEK21, putative	0.0347	0.0263	0.0074
Echinococcus granulosus	cytohesin 1	0.0275	0.0191	0.0284
Echinococcus granulosus	ribosomal protein s6 kinase beta 1	0.3353	0.3277	0.4883
Schistosoma mansoni	rho gtpase activating protein	0.0275	0.0191	0.0284
Echinococcus granulosus	Pleckstrin y	0.0275	0.0191	0.0284
Echinococcus granulosus	serine:threonine protein kinase N2	0.3353	0.3277	0.4883
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.9785	0.9725	0.9719
Echinococcus multilocularis	myotubularin protein 13	0.0275	0.0191	0.0284
Echinococcus granulosus	oxysterol binding protein 3	0.0275	0.0191	0.0284
Echinococcus multilocularis	Pleckstrin y	0.0275	0.0191	0.0284
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Entamoeba histolytica	p21-activated kinase	0.0347	0.0263	0.0074
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Echinococcus multilocularis	nervana 2	0.6432	0.6363	0.9481
Onchocerca volvulus		0.0275	0.0191	0.5
Echinococcus multilocularis	oxysterol binding protein 3	0.0275	0.0191	0.0284
Echinococcus granulosus	arf GAP with SH3 domain ANK repeat and PH	0.0275	0.0191	0.0284
Echinococcus granulosus	type II inositol 34 bisphosphate 4 phosphatase	0.0275	0.0191	0.0284
Echinococcus granulosus	calcium dependent secretion activator 1	0.0275	0.0191	0.0284
Schistosoma mansoni	serine/threonine-protein kinase	0.6779	0.6711	1
Trypanosoma cruzi	Serine/threonine-protein kinase NEK17, putative	0.0347	0.0263	0.0111
Schistosoma mansoni	syntrophin	0.0275	0.0191	0.0284
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Onchocerca volvulus	outspread protein homolog	0.0275	0.0191	0.5
Trypanosoma cruzi	Serine/threonine-protein kinase NEK17, putative	0.0347	0.0263	0.0111
Plasmodium falciparum	RAC-beta serine/threonine protein kinase	0.6504	0.6436	1
Echinococcus multilocularis	dynamin 1	0.0275	0.0191	0.0284
Echinococcus granulosus	Glutaredoxin protein 5	0.6432	0.6363	0.9481
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.0118	0.0034	0.005
Schistosoma mansoni	hypothetical protein	0.0275	0.0191	0.0284
Trypanosoma brucei	serine/threonine-protein kinase NRKB, putative	0.0347	0.0263	0.0074
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Chlamydia trachomatis	glutamine binding protein	0.0088	0.0004	0.5
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Echinococcus granulosus	Ribosomal protein S6 kinase beta 2	0.3353	0.3277	0.4883
Schistosoma mansoni	development and differentiation-enhancing factor ddef	0.0275	0.0191	0.0284
Echinococcus granulosus	dynamin 1	0.0275	0.0191	0.0284
Plasmodium falciparum	calcium-dependent protein kinase 7	0.0347	0.0263	0.0116
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Schistosoma mansoni	hypothetical protein	0.0275	0.0191	0.0284
Schistosoma mansoni	serine/threonine-protein kinase	0.6779	0.6711	1
Echinococcus multilocularis	Glutaredoxin protein 5	0.6432	0.6363	0.9481
Treponema pallidum	amino acid ABC transporter, periplasmic binding protein (hisJ)	0.0088	0.0004	0.5
Schistosoma mansoni	glutamate receptor kainate	0.0095	0.0011	0.0016
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Echinococcus granulosus	ras specific guanine nucleotide releasing factor	0.0275	0.0191	0.0284
Leishmania major	serine/threonine-protein kinase a, putative	0.0347	0.0263	1
Trichomonas vaginalis	AGC family protein kinase	1.006	1	1
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Echinococcus multilocularis	nmda type glutamate receptor	0.0132	0.0048	0.0072
Echinococcus multilocularis	Pleckstrin domain containing protein, family B	0.0275	0.0191	0.0284
Echinococcus granulosus	oxysterol binding protein 9	0.0275	0.0191	0.0284
Giardia lamblia	Kinase, AGC PKA	0.6504	0.6436	0.5
Brugia malayi	Protein kinase domain containing protein	0.3353	0.3277	0.3146
Schistosoma mansoni	rhogef and pleckstrin domain protein	0.0275	0.0191	0.0284
Entamoeba histolytica	hypothetical protein	0.0347	0.0263	0.0074
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	0.6432	0.6363	0.9481
Echinococcus multilocularis	GRB2 associated binding protein 3	0.0275	0.0191	0.0284
Trichomonas vaginalis	3-phosphoinositide dependent protein kinase-1, putative	0.0347	0.0263	0.0074
Schistosoma mansoni	centaurin alpha	0.0275	0.0191	0.0284
Echinococcus multilocularis	Pleckstrin y	0.0275	0.0191	0.0284
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Echinococcus multilocularis	arf GAP with coiled coil, ANK repeat and PH	0.0275	0.0191	0.0284
Trichomonas vaginalis	AGC family protein kinase	0.0347	0.0263	0.0074
Echinococcus granulosus	nmda type glutamate receptor	0.0132	0.0048	0.0072
Echinococcus granulosus	GRB2 associated binding protein 3	0.0275	0.0191	0.0284
Schistosoma mansoni	serine/threonine protein kinase	0.3353	0.3277	0.4883
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.3353	0.3277	0.3146
Loa Loa (eye worm)	hypothetical protein	0.3353	0.3277	0.3146
Trypanosoma cruzi	serine/threonine-protein kinase NRKB, putative	0.0347	0.0263	0.0111
Schistosoma mansoni	glutamate receptor kainate	0.0095	0.0011	0.0016
Toxoplasma gondii	calcium dependent protein kinase CDPK7	0.0347	0.0263	0.0076
Toxoplasma gondii	protein kinase domain-containing protein	0.0347	0.0263	0.0076

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 0.15 uM	Cytotoxicity against human K562 cells after 72 hrs by MTT assay	ChEMBL.	23623676

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	23623676

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: CHEMBL2387609

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1777858