TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 311.421 | Formula: C19H25N3O
H donors: 3 H acceptors: 2 LogP: 3.32 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: Oc1ccc(cc1CNC1CCCCC1)c1cnc(c(c1)C)N
InChi: 1S/C19H25N3O/c1-13-9-15(11-22-19(13)20)14-7-8-18(23)16(10-14)12-21-17-5-3-2-4-6-17/h7-11,17,21,23H,2-6,12H2,1H3,(H2,20,22)
InChiKey: JBGZVCNGAFNORC-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 multilocularis	nuclear receptor 2DBD gamma	0.001	0.0002	0.0002
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0071	0.0372	0.065
Schistosoma mansoni	hypothetical protein	0.0414	0.246	0.4321
Leishmania major	aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1	0.005	0.0247	0.6389
Trichomonas vaginalis	maltase-glucoamylase, putative	0.0037	0.0168	0.0387
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0071	0.0372	0.0653
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0002	0.0002
Toxoplasma gondii	isocitrate dehydrogenase	0.0016	0.0036	0.0729
Echinococcus multilocularis	Peptidase M1, membrane alanine aminopeptidase, N terminal	0.005	0.0247	0.0247
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0634	0.38	0.6675
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0168	0.4105
Brugia malayi	hypothetical protein	0.0435	0.2585	0.6801
Trichomonas vaginalis	alpha-glucosidase, putative	0.0037	0.0168	0.0387
Trichomonas vaginalis	alpha-glucosidase, putative	0.0014	0.0026	0.006
Toxoplasma gondii	aminopeptidase N protein	0.005	0.0247	0.4957
Trichomonas vaginalis	alpha-glucosidase, putative	0.0014	0.0026	0.006
Echinococcus granulosus	lysosomal alpha glucosidase	0.0168	0.0962	0.169
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0014	0.0026	0.0062
Echinococcus granulosus	Jumonji AT rich interactive domain 1B	0.0011	0.0008	0.0014
Echinococcus multilocularis	leukotriene A 4 hydrolase	0.0945	0.5692	0.5692
Echinococcus granulosus	lysine specific demethylase 5A	0.0036	0.0163	0.0287
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0011	0.0006	0.001
Trichomonas vaginalis	alpha-glucosidase, putative	0.0014	0.0026	0.006
Schistosoma mansoni	eyes absent homolog	0.0087	0.0471	0.0827
Echinococcus multilocularis	neutral alpha glucosidase AB	0.0037	0.0168	0.0168
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.001	0.0002	0.0004
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.001	0.0002	0.0002
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.001	0.0002	0.0004
Schistosoma mansoni	leukotriene A4 hydrolase (M01 family)	0.0945	0.5692	1
Schistosoma mansoni	coup transcription factor	0.001	0.0002	0.0004
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0116	0.0201
Echinococcus multilocularis	chaperonin containing TCP1, subunit 2 (beta)	0.0023	0.0084	0.0084
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0071	0.0372	0.1264
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0094	0.0515	0.0515
Schistosoma mansoni	hypothetical protein	0.0511	0.3051	0.536
Toxoplasma gondii	aminopeptidase n, putative	0.005	0.0247	0.4957
Giardia lamblia	Fructose-bisphosphate aldolase	0.0288	0.1696	1
Mycobacterium ulcerans	lipase LipD	0.0071	0.0372	0.2266
Loa Loa (eye worm)	histone methyltransferase	0.0012	0.0016	0.0025
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0036	0.0163	0.0287
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0372	0.065
Trichomonas vaginalis	chaperonin-60kD, ch60, putative	0.0023	0.0084	0.0194
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0219	0.0385
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.005	0.0247	0.0247
Echinococcus granulosus	ecdysone induced protein 78C	0.001	0.0002	0.0004
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0372	0.065
Entamoeba histolytica	aminopeptidase, putative	0.005	0.0247	0.1456
Trichomonas vaginalis	sucrase-isomaltase, putative	0.0037	0.0168	0.0387
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0288	0.1696	0.3915
Loa Loa (eye worm)	T-complex protein 1	0.0023	0.0084	0.0144
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0016	0.0036	0.0064
Trichomonas vaginalis	D-aminoacylase, putative	0.0071	0.0372	0.0858
Schistosoma mansoni	cpg binding protein	0.0029	0.0118	0.0208
Brugia malayi	hypothetical protein	0.0087	0.0471	0.1233
Toxoplasma gondii	PHD-finger domain-containing protein	0.0029	0.0116	0.2338
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.005	0.0247	0.0434
Leishmania major	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0016	0.0036	0.0304
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0016	0.0036	0.0304
Onchocerca volvulus		0.0722	0.4333	1
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0372	0.065
Echinococcus granulosus	GPCR family 2	0.0032	0.0135	0.0237
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0046	0.0219	0.0572
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0288	0.1696	0.3915
Schistosoma mansoni	thyroid hormone receptor	0.001	0.0002	0.0004
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0036	0.0163	0.0287
Echinococcus multilocularis	Jumonji, AT rich interactive domain 1B	0.0011	0.0008	0.0008
Loa Loa (eye worm)	transcription factor SMAD2	0.0123	0.0688	0.1206
Leishmania major	aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1	0.005	0.0247	0.6389
Echinococcus granulosus	neutral alpha glucosidase AB	0.0037	0.0168	0.0295
Loa Loa (eye worm)	PHD-finger family protein	0.0029	0.0116	0.0201
Schistosoma mansoni	nuclear hormone receptor	0.001	0.0002	0.0004
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0071	0.0372	0.1264
Toxoplasma gondii	glycosyl hydrolase, family 31 protein	0.0037	0.0168	0.337
Plasmodium falciparum	phd finger protein, putative	0.0029	0.0116	0.4717
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0168	0.0962	0.0962
Mycobacterium tuberculosis	Probable esterase LipL	0.0071	0.0372	0.1264
Brugia malayi	latrophilin 2 splice variant baaae	0.0069	0.036	0.0941
Schistosoma mansoni	steroid hormone receptor ad4bp	0.001	0.0002	0.0004
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.005	0.0247	0.0247
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.005	0.0247	0.0434
Giardia lamblia	TCP-1 chaperonin subunit beta	0.0023	0.0084	0.0495
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0016	0.0036	0.0304
Mycobacterium tuberculosis	Conserved protein	0.0071	0.0372	0.1264
Schistosoma mansoni	aminopeptidase A (M01 family)	0.005	0.0247	0.0434
Schistosoma mansoni	hypothetical protein	0.0032	0.0135	0.0237
Plasmodium vivax	SET domain protein, putative	0.0092	0.0498	1
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0026	0.0041
Trypanosoma brucei	aminopeptidase, putative	0.005	0.0247	0.6389
Onchocerca volvulus		0.0097	0.0532	0.1223
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0037	0.0168	0.099
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0168	0.0962	0.2527
Echinococcus multilocularis	jumonji domain containing protein	0.004	0.0185	0.0185
Brugia malayi	Peptidase family M1 containing protein	0.005	0.0247	0.0644
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0288	0.1696	0.3915
Echinococcus granulosus	peregrin	0.0029	0.0116	0.0205
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0036	0.0036
Trypanosoma brucei	T-complex protein 1, beta subunit, putative	0.0023	0.0084	0.1683
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0037	0.0168	0.099
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0014	0.0026	0.0152
Plasmodium vivax	M1-family alanyl aminopeptidase, putative	0.005	0.0247	0.4957
Schistosoma mansoni	alpha-glucosidase	0.0144	0.082	0.144
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0092	0.0498	0.0498
Brugia malayi	hypothetical protein	0.005	0.0247	0.0644
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0242	0.0421
Trichomonas vaginalis	alpha-glucosidase, putative	0.0037	0.0168	0.0387
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0016	0.0036	0.0064
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0288	0.1696	0.3915
Mycobacterium ulcerans	hypothetical protein	0.0071	0.0372	0.2266
Trichomonas vaginalis	alpha-glucosidase, putative	0.0037	0.0168	0.0387
Trypanosoma cruzi	puromycin-sensitive aminopeptidase-like protein, putative	0.005	0.0247	0.6389
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0452	0.2692	1
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0288	0.1696	1
Echinococcus multilocularis	thyroid hormone receptor alpha	0.001	0.0002	0.0002
Trichomonas vaginalis	chaperonin, putative	0.0023	0.0084	0.0194
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0058	0.0297	0.5957
Trypanosoma cruzi	T-complex protein 1, beta subunit, putative	0.0023	0.0084	0.1683
Loa Loa (eye worm)	hypothetical protein	0.0087	0.0471	0.0823
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0101	0.0553	0.1451
Brugia malayi	PHD-finger family protein	0.0029	0.0116	0.0301
Plasmodium falciparum	isocitrate dehydrogenase [NADP], mitochondrial	0.0016	0.0036	0.147
Giardia lamblia	PHD finger protein 15	0.0029	0.0116	0.0687
Brugia malayi	Peptidase family M1 containing protein	0.005	0.0247	0.0644
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0029	0.0118	0.0204
Leishmania major	puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1	0.005	0.0247	0.6389
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0101	0.0553	0.1451
Echinococcus granulosus	histone lysine methyltransferase setb	0.0092	0.0498	0.0875
Echinococcus granulosus	dnaJ subfamily B	0.0414	0.246	0.4321
Trichomonas vaginalis	penicillin-binding protein, putative	0.0071	0.0372	0.0858
Schistosoma mansoni	cpg binding protein	0.0031	0.0128	0.0225
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0016	0.0036	0.0729
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0168	0.0962	0.0962
Schistosoma mansoni	cpg binding protein	0.0031	0.0128	0.0225
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0168	0.4105
Loa Loa (eye worm)	jmjC domain-containing protein	0.0059	0.0303	0.0528
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0219	0.0385
Schistosoma mansoni	hypothetical protein	0.0069	0.036	0.0632
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0288	0.1696	0.3915
Plasmodium vivax	M1-family alanyl aminopeptidase, putative	0.005	0.0247	0.4957
Onchocerca volvulus		0.0071	0.0372	0.0854
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.001	0.0002	0.0002
Trichomonas vaginalis	D-aminoacylase, putative	0.0071	0.0372	0.0858
Trypanosoma cruzi	aminopeptidase, putative	0.005	0.0247	0.6389
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.001	0.0002	0.0004
Leishmania major	T-complex protein 1, beta subunit, putative	0.0023	0.0084	0.1683
Brugia malayi	Peptidase family M1 containing protein	0.005	0.0247	0.0644
Trichomonas vaginalis	alpha-glucosidase, putative	0.0014	0.0026	0.006
Trypanosoma cruzi	aminopeptidase, putative	0.005	0.0247	0.6389
Schistosoma mansoni	chaperonin containing t-complex protein 1 beta subunit tcpb	0.0023	0.0084	0.0148
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0011	0.0006	0.001
Trypanosoma brucei	metallo-peptidase, Clan MA(E) Family M1	0.005	0.0247	0.6389
Plasmodium vivax	hypothetical protein, conserved	0.0029	0.0116	0.2338
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0032	0.0135	0.0135
Echinococcus multilocularis	GPCR, family 2	0.0032	0.0135	0.0135
Trichomonas vaginalis	set domain proteins, putative	0.0722	0.4333	1
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0036	0.0036
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0009	0.0012
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0012	0.0016	0.0029
Brugia malayi	beta-lactamase	0.0071	0.0372	0.0974
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0071	0.0372	0.0653
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.005	0.0247	0.0247
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0037	0.0168	0.0387
Echinococcus granulosus	beta LACTamase domain containing family member	0.0071	0.0372	0.0653
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0219	0.0219
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0032	0.0135	0.035
Trypanosoma brucei	glucosidase, putative	0.0037	0.0168	0.4105
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.005	0.0247	0.0434
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0046	0.0219	0.0382
Trichomonas vaginalis	esterase, putative	0.0071	0.0372	0.0858
Trypanosoma brucei	hypothetical protein, conserved	0.0071	0.0372	1
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0071	0.0372	0.0974
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.001	0.0002	0.0004
Echinococcus granulosus	chaperonin containing TCP1 subunit 2 beta	0.0023	0.0084	0.0148
Trichomonas vaginalis	alpha-glucosidase, putative	0.0037	0.0168	0.0387
Echinococcus multilocularis	lysine specific demethylase 5A	0.0035	0.0153	0.0153
Mycobacterium tuberculosis	Probable lipase LipD	0.0071	0.0372	0.1264
Entamoeba histolytica	T-complex protein 1 beta subunit, putative	0.0023	0.0084	0.0495
Loa Loa (eye worm)	TATA binding protein associated factor	0.005	0.0247	0.043
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0032	0.0135	0.0135
Brugia malayi	Pre-SET motif family protein	0.0634	0.38	1
Trichomonas vaginalis	alpha-glucosidase, putative	0.0037	0.0168	0.0387
Loa Loa (eye worm)	peptidase family M1 containing protein	0.005	0.0247	0.043
Echinococcus multilocularis	peregrin	0.0029	0.0116	0.0116
Plasmodium vivax	T-complex protein 1 subunit beta, putative	0.0023	0.0084	0.1687
Mycobacterium ulcerans	beta-lactamase	0.0071	0.0372	0.2266
Echinococcus multilocularis	cpg binding protein	0.0031	0.0128	0.0128
Echinococcus granulosus	cpg binding protein	0.0031	0.0128	0.0225
Trichomonas vaginalis	alpha-glucosidase, putative	0.0014	0.0026	0.006
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0372	0.065
Mycobacterium tuberculosis	Probable lipase LipE	0.0071	0.0372	0.1264
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.005	0.0247	0.057
Onchocerca volvulus		0.005	0.0247	0.0565
Trypanosoma brucei	Aminopeptidase M1, putative	0.005	0.0247	0.6389
Trichomonas vaginalis	D-aminoacylase, putative	0.0071	0.0372	0.0858
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0012	0.0016	0.0016
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.001	0.0002	0.0004
Toxoplasma gondii	isocitrate dehydrogenase	0.0016	0.0036	0.0729
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0219	0.0385
Toxoplasma gondii	t-complex protein beta subunit	0.0023	0.0084	0.1687
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.005	0.0247	0.0434
Loa Loa (eye worm)	hypothetical protein	0.0087	0.0471	0.0823
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.005	0.0247	0.057
Loa Loa (eye worm)	leukotriene A4 hydrolase	0.0945	0.5692	1
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0372	0.065
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0016	0.0036	0.0304
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0002	0.0004
Loa Loa (eye worm)	hypothetical protein	0.0101	0.0553	0.0969
Loa Loa (eye worm)	hypothetical protein	0.0092	0.0498	0.0872
Trypanosoma cruzi	Aminopeptidase M1, putative	0.005	0.0247	0.6389
Schistosoma mansoni	chaperonin containing t-complex protein 1 beta subunit tcpb	0.0023	0.0084	0.0148
Mycobacterium ulcerans	esterase/lipase LipP	0.0071	0.0372	0.2266
Brugia malayi	Pre-SET motif family protein	0.0092	0.0498	0.1306
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.002	0.0063	0.0111
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0036	0.0036
Schistosoma mansoni	RAR-like nuclear receptor	0.001	0.0002	0.0004
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.001	0.0002	0.0004
Schistosoma mansoni	chaperonin containing t-complex protein 1 beta subunit tcpb	0.0023	0.0084	0.0148
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.001	0.0002	0.0004
Trypanosoma cruzi	metallo-peptidase, clan MA(E), family M1, putative	0.005	0.0247	0.6389
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0037	0.0168	0.0291
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0065	0.0337	0.0592
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0092	0.0498	1
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.001	0.0002	0.0004
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.005	0.0247	0.0247
Echinococcus granulosus	leukotriene A 4 hydrolase	0.0945	0.5692	1
Leishmania major	aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1	0.005	0.0247	0.6389
Onchocerca volvulus		0.0092	0.0498	0.1145
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.005	0.0247	0.0247
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.001	0.0002	0.0004
Mycobacterium tuberculosis	Conserved protein	0.0071	0.0372	0.1264
Onchocerca volvulus	Alhambra homolog	0.0029	0.0116	0.0264
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0141	0.0799	1
Schistosoma mansoni	jumonji domain containing protein	0.0075	0.0397	0.0697
Trypanosoma brucei	Aminopeptidase M1, putative	0.005	0.0247	0.6389
Onchocerca volvulus		0.0029	0.0118	0.0268
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.005	0.0247	0.057
Mycobacterium tuberculosis	Conserved protein	0.0071	0.0372	0.1264
Onchocerca volvulus		0.0071	0.0372	0.0854
Plasmodium falciparum	M1-family alanyl aminopeptidase, putative	0.005	0.0247	1
Brugia malayi	F/Y-rich N-terminus family protein	0.0022	0.0073	0.0186
Onchocerca volvulus		0.005	0.0247	0.0565
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0071	0.0372	0.0372
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.0219	0.0385
Brugia malayi	Bromodomain containing protein	0.0029	0.0116	0.0301
Echinococcus multilocularis	isocitrate dehydrogenase	0.0016	0.0036	0.0036
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0092	0.0498	0.0875
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0094	0.0515	0.0904
Loa Loa (eye worm)	jmjC domain-containing protein	0.0036	0.0163	0.0283
Trypanosoma cruzi	hypothetical protein, conserved	0.0071	0.0372	1
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.001	0.0002	0.0002
Brugia malayi	T-complex protein 1, beta subunit	0.0023	0.0084	0.0216
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.0219	0.0385
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.001	0.0002	0.0002
Schistosoma mansoni	hypothetical protein	0.0032	0.0135	0.0237
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0135	0.0233
Treponema pallidum	fructose-bisphosphate aldolase	0.0288	0.1696	0.5
Loa Loa (eye worm)	beta-lactamase	0.0071	0.0372	0.065
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.0029	0.0116	0.0205
Loa Loa (eye worm)	hypothetical protein	0.005	0.0247	0.043
Brugia malayi	jmjC domain containing protein	0.0036	0.0163	0.0424
Trypanosoma cruzi	puromycin-sensitive aminopeptidase-like protein, putative	0.005	0.0247	0.6389
Brugia malayi	T-complex protein 1, beta subunit	0.0023	0.0084	0.0216
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0092	0.0498	0.0875
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0037	0.0168	0.0387
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0141	0.0799	0.2871
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0092	0.0498	0.0875
Echinococcus granulosus	aminopeptidase N	0.005	0.0247	0.0434
Loa Loa (eye worm)	hypothetical protein	0.005	0.0247	0.043
Brugia malayi	MH2 domain containing protein	0.0123	0.0688	0.1806
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0088	0.0474	0.0833
Onchocerca volvulus		0.005	0.0247	0.0565
Trichomonas vaginalis	penicillin-binding protein, putative	0.0071	0.0372	0.0858
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0141	0.0799	1
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.005	0.0247	0.0434
Schistosoma mansoni	hypothetical protein	0.0029	0.0116	0.0205
Echinococcus granulosus	geminin	0.0511	0.3051	0.536
Plasmodium falciparum	M1-family alanyl aminopeptidase	0.005	0.0247	1
Brugia malayi	PHD-finger family protein	0.0011	0.0009	0.0017
Trypanosoma cruzi	metallo-peptidase, clan MA(E), family M1, putative	0.005	0.0247	0.6389
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0288	0.1696	1
Brugia malayi	beta-lactamase family protein	0.0071	0.0372	0.0974
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0032	0.0135	0.0237
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0016	0.0036	0.0036
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0092	0.0498	0.0498
Plasmodium falciparum	conserved Plasmodium membrane protein, unknown function	0.0011	0.0009	0.0382
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.001	0.0002	0.0004
Schistosoma mansoni	alpha-glucosidase	0.0144	0.082	0.144
Brugia malayi	jmjC domain containing protein	0.0094	0.0515	0.135
Mycobacterium tuberculosis	Probable hydrolase	0.0071	0.0372	0.1264
Echinococcus granulosus	FTZ F1 alpha	0.001	0.0002	0.0004
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0002	0.0004
Schistosoma mansoni	hypothetical protein	0.0032	0.0135	0.0237
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0014	0.0026	0.006
Onchocerca volvulus		0.0071	0.0372	0.0854
Brugia malayi	Isocitrate dehydrogenase	0.0016	0.0036	0.009
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.001	0.0002	0.0004
Loa Loa (eye worm)	aminopeptidase N	0.005	0.0247	0.043
Schistosoma mansoni	Tata binding protein associated factor (M01 family)	0.005	0.0247	0.0434
Echinococcus multilocularis	geminin	0.0511	0.3051	0.3051
Onchocerca volvulus	Uncharacterized family 31 glucosidase KIAA1161 homolog	0.0014	0.0026	0.0054
Schistosoma mansoni	alpha glucosidase	0.0037	0.0168	0.0295
Echinococcus granulosus	jumonji domain containing protein	0.004	0.0185	0.0325
Brugia malayi	CXXC zinc finger family protein	0.0029	0.0118	0.0306
Leishmania major	alpha glucosidase II subunit, putative	0.0037	0.0168	0.4105
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.005	0.0247	0.0434
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0288	0.1696	0.3915
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0037	0.0168	0.0436
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0014	0.0026	0.006
Leishmania major	hypothetical protein, conserved	0.0071	0.0372	1
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0016	0.0036	0.006
Schistosoma mansoni	cytosol alanyl aminopeptidase (M01 family)	0.005	0.0247	0.0434
Brugia malayi	Latrophilin receptor protein 2	0.0032	0.0135	0.035
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0071	0.0372	0.2266
Trypanosoma cruzi	hypothetical protein, conserved	0.0071	0.0372	1
Schistosoma mansoni	hypothetical protein	0.0032	0.0135	0.0237
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0372	0.065
Trypanosoma cruzi	metallo-peptidase, Clan MA(E) Family M1	0.005	0.0247	0.6389
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0288	0.1696	0.3915
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0011	0.0006	0.0006
Brugia malayi	isocitrate dehydrogenase	0.0016	0.0036	0.009
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0288	0.1696	0.3915
Echinococcus multilocularis	PHD finger protein rhinoceros	0.0029	0.0116	0.0116
Loa Loa (eye worm)	MH2 domain-containing protein	0.0123	0.0688	0.1206
Echinococcus multilocularis	FTZ F1 alpha	0.001	0.0002	0.0002
Plasmodium vivax	hypothetical protein, conserved	0.0011	0.0009	0.0189
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.0219	0.0219
Schistosoma mansoni	thyroid hormone receptor	0.001	0.0002	0.0004
Loa Loa (eye worm)	hypothetical protein	0.0069	0.036	0.0628
Toxoplasma gondii	aminopeptidase N, putative	0.005	0.0247	0.4957
Brugia malayi	beta-lactamase family protein	0.0071	0.0372	0.0974
Echinococcus multilocularis	dnaJ subfamily B	0.0414	0.246	0.246
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0168	0.0962	0.1687
Echinococcus multilocularis	ecdysone induced protein 78C	0.001	0.0002	0.0002
Schistosoma mansoni	hypothetical protein	0.0511	0.3051	0.536
Echinococcus multilocularis	aminopeptidase N	0.005	0.0247	0.0247
Trichomonas vaginalis	maltase-glucoamylase, putative	0.0014	0.0026	0.006
Plasmodium falciparum	T-complex protein 1 subunit beta	0.0023	0.0084	0.3403
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.005	0.0247	0.0434
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0092	0.0498	0.0875
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0032	0.0135	0.0233
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0016	0.0036	0.0304
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0071	0.0372	0.1264
Toxoplasma gondii	PHD-finger domain-containing protein	0.0029	0.0116	0.2338
Echinococcus granulosus	PHD finger protein rhinoceros	0.0029	0.0116	0.0205
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0032	0.0135	0.0237
Loa Loa (eye worm)	hypothetical protein	0.005	0.0247	0.043
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0101	0.0553	0.0969
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0011	0.0006	0.0006
Schistosoma mansoni	retinoic acid receptor RXR	0.001	0.0002	0.0004
Plasmodium vivax	hypothetical protein, conserved	0.0071	0.0372	0.7465
Brugia malayi	TATA binding protein associated factor	0.005	0.0247	0.0644
Brugia malayi	hypothetical protein	0.005	0.0247	0.0644
Toxoplasma gondii	ABC1 family protein	0.0071	0.0372	0.7465

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (functional)	= 0 %	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 LDH activity, using an LDH reporter assay. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition (functional)	= 0.43 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGLUT1 that are glucose transport deficient and complemented with the human glucose transporter GLUT1. Activity is measured by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 0.95 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGT2 that are glucose transport deficient and complemented with the L. Mexicana glucose transporter 2. Activity is measured by by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 10.33 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmPfHT that are glucose transport deficient and complemented with the Plasmodium falciparum hexose transporter. Activity is measured by by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 27 %	GSK_TCMDC: Percent inhibition of human HepG2 cell line. Test compounds present at 10uM.	ChEMBL.	20485427
Inhibition (functional)	= 100 %	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition (functional)	= 100 %	GSK_TCMDC: Inhibition of Plasmodium falciparum Dd2 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition frequency index (IFI) (functional)	= 3.33	Inhibition Frequency Index (IFI)	GSK.	20485427
Percent growth inhibition (functional)	= -4 %	Percent inhibition of P. falciparum lactate dehydrogenase activity (at 2 uM)	GSK.	20485427
Percent growth inhibition (functional)	= 27 %	Percent inhibition of HepG2 growth (at 10 uM)	GSK.	20485427
Percent growth inhibition (functional)	= 100 %	Percent inhibition of P. falciparum Dd2 growth (at 2 uM)	GSK.	20485427
Percent growth inhibition (functional)	= 102 %	Percent inhibition of P. falciparum 3D7 growth (at 2 uM)	GSK.	20485427
XC50 (functional)	= 6.69	XC50 determination of P. falciparum 3D7 growth	GSK.	20485427
XC50 (functional)	= 0.20287 uM	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole erythrocytes, using parasite LDH activity as an index of growth.	ChEMBL.	20485427

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: CHEMBL526620
Search by GSK

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 599394