TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 378.348 | Formula: C18H17F3N4O2
H donors: 2 H acceptors: 2 LogP: 2.35 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: Cc1ccc(nc1)C(=O)Nc1ccc(c(c1)[C@@]1(C)N=C(N)OCC1(F)F)F
InChi: 1S/C18H17F3N4O2/c1-10-3-6-14(23-8-10)15(26)24-11-4-5-13(19)12(7-11)17(2)18(20,21)9-27-16(22)25-17/h3-8H,9H2,1-2H3,(H2,22,25)(H,24,26)/t17-/m1/s1
InChiKey: ZCNHRJGLINKQLI-QGZVFWFLSA-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

Species	Target name	Source	Bibliographic reference
Homo sapiens	beta-site APP-cleaving enzyme 2	Starlite/ChEMBL	References
Homo sapiens	beta-site APP-cleaving enzyme 1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma mansoni	memapsin-2 (A01 family)	Get druggable targets OG5_135830	All targets in OG5_135830
Schistosoma japonicum	ko:K07747 beta-site APP-cleaving enzyme 2 (memapsin 1) [EC3.4.23.45], putative	Get druggable targets OG5_135830	All targets in OG5_135830

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Plasmodium falciparum	plasmepsin V	beta-site APP-cleaving enzyme 2	518 aa	439 aa	21.9 %
Plasmodium falciparum	plasmepsin VII	beta-site APP-cleaving enzyme 1	401 aa	352 aa	21.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	SH2 domain containing protein	0.1324	0.329	0.329
Trichomonas vaginalis	conserved hypothetical protein	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	CAMK family protein kinase	0.0888	0	0.5
Brugia malayi	SH2 domain containing protein	0.1324	0.329	0.329
Schistosoma mansoni	tensin	0.1324	0.329	0.329
Echinococcus granulosus	tyrosine protein kinase Srms	0.2213	1	1
Onchocerca volvulus		0.1324	0.329	0.329
Schistosoma mansoni	shc transforming protein	0.1324	0.329	0.329
Echinococcus granulosus	growth factor receptor bound protein 2	0.1324	0.329	0.329
Toxoplasma gondii	protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus granulosus	tyrosine protein kinase Src64B	0.2213	1	1
Loa Loa (eye worm)	TK/FER protein kinase	0.2213	1	1
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Echinococcus multilocularis	N chimaerin	0.1324	0.329	0.329
Brugia malayi	Protein kinase domain containing protein	0.2213	1	1
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Brugia malayi	protein-tyrosine kinase	0.2213	1	1
Echinococcus granulosus	NCK adaptor protein	0.1324	0.329	0.329
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.2213	1	1
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Onchocerca volvulus		0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Loa Loa (eye worm)	STAT protein	0.1324	0.329	0.329
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Echinococcus multilocularis	suppressor of cytokine signaling 7	0.1324	0.329	0.329
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.0888	0	0.5
Schistosoma mansoni	GTPase activating protein	0.1324	0.329	0.329
Toxoplasma gondii	protein kinase domain-containing protein	0.0888	0	0.5
Echinococcus multilocularis	growth factor receptor bound protein 2	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Onchocerca volvulus		0.2213	1	1
Loa Loa (eye worm)	TK/FER protein kinase	0.2213	1	1
Plasmodium falciparum	tyrosine kinase-like protein	0.0888	0	0.5
Schistosoma mansoni	suppressor of cytokine signaling	0.1324	0.329	0.329
Brugia malayi	Variant SH3 domain containing protein	0.1324	0.329	0.329
Onchocerca volvulus		0.2213	1	1
Plasmodium vivax	tyrosine kinase-like protein, putative	0.0888	0	0.5
Schistosoma mansoni	tyrosine kinase	0.2213	1	1
Trypanosoma brucei	Flagellum attachment zone protein 20	0.0888	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Echinococcus granulosus	tyrosine protein kinase Fyn	0.2213	1	1
Brugia malayi	hypothetical protein	0.2213	1	1
Trichomonas vaginalis	serine/threonine-protein kinase wnk, putative	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.2213	1	1
Echinococcus multilocularis	phosphatidylinositol 3 kinase regulatory subunit	0.1324	0.329	0.329
Schistosoma mansoni	tyrosine-protein kinase zap-70	0.1324	0.329	0.329
Schistosoma mansoni	tyrosine kinase	0.2213	1	1
Leishmania major	hypothetical protein, conserved	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus granulosus	signal transduction protein lnk realted	0.1324	0.329	0.329
Toxoplasma gondii	STE kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.2213	1	1
Schistosoma mansoni	growth factor receptor-bound protein	0.1324	0.329	0.329
Trichomonas vaginalis	protein tyrosine kinase, putative	0.0888	0	0.5
Schistosoma mansoni	signal transduction protein lnk-related	0.1324	0.329	0.329
Trypanosoma cruzi	protein kinase, putative	0.0888	0	0.5
Brugia malayi	Protein kinase domain containing protein	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0888	0	0.5
Schistosoma mansoni	tensin	0.1324	0.329	0.329
Loa Loa (eye worm)	SH2 domain-containing protein	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Brugia malayi	SRC-1	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus multilocularis	SH2 motif	0.1324	0.329	0.329
Trichomonas vaginalis	br serine/threonine-protein kinase, putative	0.0888	0	0.5
Loa Loa (eye worm)	SH2 domain-containing protein	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus granulosus	tyrosine kinase	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Blk	0.2213	1	1
Echinococcus multilocularis	tensin	0.1324	0.329	0.329
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Trichomonas vaginalis	protein kinase atn1, putative	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Brugia malayi	SH2 domain containing protein	0.1324	0.329	0.329
Echinococcus granulosus	tyrosine protein kinase Blk	0.2213	1	1
Entamoeba histolytica	protein kinase, putative	0.1324	0.329	0.329
Echinococcus multilocularis	SH2 motif	0.1324	0.329	0.329
Brugia malayi	Variant SH3 domain containing protein	0.1324	0.329	0.329
Echinococcus granulosus	tyrosine protein kinase Fps85D	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus granulosus	suppressor of cytokine signaling 7	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Schistosoma mansoni	adapter molecule crk	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Onchocerca volvulus		0.1324	0.329	0.329
Echinococcus multilocularis	tyrosine protein kinase Btk29A	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Plasmodium falciparum	protein kinase, putative	0.0888	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.2213	1	1
Echinococcus multilocularis	guanine nucleotide exchange factor VAV2	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Brugia malayi	SH2 domain containing protein	0.2213	1	1
Echinococcus multilocularis	NCK adaptor protein	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.1324	0.329	0.329
Brugia malayi	SH2 domain containing protein	0.2213	1	1
Echinococcus granulosus	tyrosine protein kinase Src42A	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Schistosoma mansoni	tyrosine kinase	0.2213	1	1
Echinococcus multilocularis	tyrosine protein kinase shark	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Schistosoma mansoni	protein tyrosine phosphatase n11 (shp2)	0.1324	0.329	0.329
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.1324	0.329	0.329
Loa Loa (eye worm)	TK/FER protein kinase	0.2213	1	1
Echinococcus granulosus	suppressor of cytokine signaling 6	0.1324	0.329	0.329
Leishmania major	protein kinase, putative	0.0888	0	0.5
Schistosoma mansoni	tyrosine kinase	0.2213	1	1
Echinococcus multilocularis	tyrosine protein kinase ABL1	0.2213	1	1
Loa Loa (eye worm)	SRC-1	0.2213	1	1
Trypanosoma brucei	Pseudokinase, putative	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Toxoplasma gondii	calcium dependent protein kinase CDPK8	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus granulosus	c src tyrosine kinase	0.2213	1	1
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.2213	1	1
Loa Loa (eye worm)	TK/ABL protein kinase	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Onchocerca volvulus		0.1324	0.329	0.329
Trichomonas vaginalis	conserved hypothetical protein	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Loa Loa (eye worm)	cytokine inducible SH2-containing protein 5	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Onchocerca volvulus		0.2213	1	1
Loa Loa (eye worm)	TK protein kinase	0.2213	1	1
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase abl1	0.1324	0.329	0.329
Echinococcus multilocularis	suppressor of cytokine signaling 6	0.1324	0.329	0.329
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Giardia lamblia	Protein 21.1	0.0888	0	0.5
Leishmania major	protein kinase, putative	0.0888	0	0.5
Schistosoma mansoni	SH2A	0.1324	0.329	0.329
Echinococcus granulosus	tyrosine protein kinase shark	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TK family protein kinase	0.0888	0	0.5
Onchocerca volvulus	Suppressor of cytokine signaling at 36E homolog	0.1324	0.329	0.329
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0888	0	0.5
Echinococcus granulosus	tyrosine protein kinase Btk29A	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus granulosus	phosphatidylinositol 3 kinase regulatory subunit	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.2213	1	1
Echinococcus granulosus	N chimaerin	0.1324	0.329	0.329
Brugia malayi	SH2 domain containing protein	0.1324	0.329	0.329
Schistosoma mansoni	growth factor receptor-bound protein	0.1324	0.329	0.329
Echinococcus multilocularis	signal transduction protein lnk realted	0.1324	0.329	0.329
Plasmodium vivax	protein kinase, putative	0.0888	0	0.5
Echinococcus granulosus	expressed conserved protein	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.1324	0.329	0.329
Trichomonas vaginalis	ankyrin repeat-containing protein, putative	0.0888	0	0.5
Echinococcus multilocularis	SH2 domain containing protein 7	0.1324	0.329	0.329
Brugia malayi	SH2 domain containing protein	0.1324	0.329	0.329
Echinococcus multilocularis	tyrosine protein kinase Srms	0.2213	1	1
Schistosoma mansoni	tensin-related	0.1324	0.329	0.329
Plasmodium falciparum	protein kinase, putative	0.0888	0	0.5
Schistosoma mansoni	tensin	0.1324	0.329	0.329
Onchocerca volvulus		0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus granulosus	tyrosine protein kinase Src42A	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Brugia malayi	Tyrosine-protein kinase abl-1	0.2213	1	1
Loa Loa (eye worm)	TK/FER protein kinase	0.2213	1	1
Schistosoma mansoni	tyrosine kinase	0.2213	1	1
Echinococcus multilocularis	tyrosine protein kinase Abl	0.2213	1	1
Plasmodium falciparum	protein kinase, putative	0.0888	0	0.5
Brugia malayi	RhoGAP domain containing protein	0.1324	0.329	0.329
Loa Loa (eye worm)	TK/FER protein kinase	0.2213	1	1
Echinococcus multilocularis	tyrosine kinase	0.2213	1	1
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.1324	0.329	0.329
Trichomonas vaginalis	conserved hypothetical protein	0.0888	0	0.5
Echinococcus granulosus	hypothetical protein	0.1324	0.329	0.329
Toxoplasma gondii	Tyrosine kinase-like (TKL) protein	0.0888	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.2213	1	1
Loa Loa (eye worm)	TK/FER protein kinase	0.2213	1	1
Echinococcus multilocularis		0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trypanosoma cruzi	protein kinase, putative	0.0888	0	0.5
Echinococcus granulosus	SH2 motif	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus granulosus	tyrosine protein kinase ABL1	0.2213	1	1
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.1324	0.329	0.329
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Fps85D	0.2213	1	1
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.1324	0.329	0.329
Giardia lamblia	Kinase, NEK	0.0888	0	0.5
Trichomonas vaginalis	STE family protein kinase	0.0888	0	0.5
Echinococcus granulosus	SH2 motif	0.1324	0.329	0.329
Echinococcus multilocularis	suppressor of cytokine signaling 7	0.1324	0.329	0.329
Echinococcus granulosus	SH2 domain containing adapter protein F	0.1324	0.329	0.329
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.2213	1	1
Giardia lamblia	Kinase, NEK	0.0888	0	0.5
Trypanosoma brucei	STE/STE11 serine/threonine-protein kinase, putative	0.0888	0	0.5
Entamoeba histolytica	SH2 domain containing protein	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Brugia malayi	Tensin	0.1324	0.329	0.329
Loa Loa (eye worm)	TK/FER protein kinase	0.2213	1	1
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Giardia lamblia	Kinase	0.0888	0	0.5
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.2213	1	1
Trypanosoma brucei	AGC/RSK family serine/threonine kinase, putative	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Brugia malayi	Variant SH3 domain containing protein	0.1324	0.329	0.329
Echinococcus multilocularis	SHC transforming protein 3	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Schistosoma mansoni	vav2	0.1324	0.329	0.329
Schistosoma mansoni	nck2/grb4	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Plasmodium vivax	tyrosine kinase-like protein, putative	0.0888	0	0.5
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0888	0	0.5
Echinococcus multilocularis	SH2 motif	0.1324	0.329	0.329
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.1324	0.329	0.329
Echinococcus granulosus	tyrosine protein kinase Lyn	0.2213	1	1
Schistosoma mansoni	hypothetical protein	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus multilocularis	c src tyrosine kinase	0.2213	1	1
Brugia malayi	Variant SH3 domain containing protein	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.1324	0.329	0.329
Schistosoma mansoni	hypothetical protein	0.1324	0.329	0.329
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.1324	0.329	0.329
Onchocerca volvulus		0.1324	0.329	0.329
Loa Loa (eye worm)	sex muscle abnormal protein 5	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.2213	1	1
Brugia malayi	hypothetical protein	0.1324	0.329	0.329
Brugia malayi	STAT protein, DNA binding domain containing protein	0.1324	0.329	0.329
Schistosoma mansoni	suppressor of cytokine signaling	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Onchocerca volvulus		0.2213	1	1
Loa Loa (eye worm)	TK/FER protein kinase	0.2213	1	1
Trypanosoma brucei	protein kinase, putative	0.0888	0	0.5
Onchocerca volvulus		0.2213	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0888	0	0.5
Loa Loa (eye worm)	TK/FER protein kinase	0.2213	1	1
Echinococcus granulosus	tensin	0.1324	0.329	0.329
Brugia malayi	cytokine inducible SH2-containing protein 5	0.1324	0.329	0.329
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase src	0.2213	1	1
Echinococcus granulosus	guanine nucleotide exchange factor VAV2	0.1324	0.329	0.329
Loa Loa (eye worm)	TK/FER protein kinase	0.2213	1	1
Echinococcus granulosus	tyrosine kinase	0.2213	1	1
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Echinococcus granulosus	SH2 domain containing protein 7	0.1324	0.329	0.329
Brugia malayi	Protein kinase domain containing protein	0.2213	1	1
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.1324	0.329	0.329
Echinococcus granulosus	tensin C1 domain containing phosphatase	0.1324	0.329	0.329
Schistosoma mansoni	tyrosine kinase	0.2213	1	1
Schistosoma mansoni	tensin-related	0.1324	0.329	0.329
Brugia malayi	SH2 domain containing protein	0.1324	0.329	0.329
Echinococcus granulosus	SHC transforming protein 3	0.1324	0.329	0.329
Trichomonas vaginalis	serine-threonine protein kinase, putative	0.0888	0	0.5
Brugia malayi	tRNA modification GTPase TrmE family protein	0.1324	0.329	0.329
Brugia malayi	SH2 domain containing protein	0.1324	0.329	0.329
Trichomonas vaginalis	conserved hypothetical protein	0.0888	0	0.5
Echinococcus multilocularis	tensin	0.1324	0.329	0.329
Onchocerca volvulus		0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Onchocerca volvulus	Suppressor of cytokine signaling 7 homolog	0.1324	0.329	0.329
Brugia malayi	Protein kinase domain containing protein	0.2213	1	1
Trichomonas vaginalis	AGC family protein kinase	0.0888	0	0.5
Echinococcus granulosus	tyrosine protein kinase Fyn	0.2213	1	1
Loa Loa (eye worm)	hypothetical protein	0.1324	0.329	0.329
Brugia malayi	Sex muscle abnormal protein 5	0.1324	0.329	0.329
Loa Loa (eye worm)	SH2 domain-containing protein	0.1324	0.329	0.329
Echinococcus granulosus	tyrosine protein kinase Fyn	0.2213	1	1
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.2213	1	1
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5
Echinococcus multilocularis	SH2 domain containing adapter protein F	0.1324	0.329	0.329
Plasmodium falciparum	tyrosine kinase-like protein	0.0888	0	0.5
Loa Loa (eye worm)	RhoGAP domain-containing protein	0.1324	0.329	0.329
Trichomonas vaginalis	TKL family protein kinase	0.0888	0	0.5

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.03 uM	Inhibition of human BACE2 using MR121-labeled substrate incubated for 4 mins prior to substrate addition measured after 2 mins by spectrophotometric analysis	ChEMBL.	23590342
IC50 (binding)	= 0.087 uM	Inhibition of human BACE1 in HEK293 cells transfected with wild type APP assessed as reduction of amyloid beta40 level after 18 to 20 hrs by AlphaLISA technique	ChEMBL.	23590342
IC50 (binding)	= 0.087 uM	Inhibition of human BACE1 using MR121-labeled substrate incubated for 4 mins prior to substrate addition measured after 2 mins by spectrophotometric analysis	ChEMBL.	23590342
Ratio IC50 (binding)	= 1	Selectivity ratio of IC50 for human BACE1 to IC50 for BACE1 in HEK293 cells	ChEMBL.	23590342

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: CHEMBL2347363

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1760028