TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 457.534 | Formula: C25H30F3N5
H donors: 2 H acceptors: 2 LogP: 6.72 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CCN(C1CCC(CC1)Nc1nc(Nc2ccc(cc2)C(F)(F)F)c2c(n1)cccc2)CC
InChi: 1S/C25H30F3N5/c1-3-33(4-2)20-15-13-19(14-16-20)30-24-31-22-8-6-5-7-21(22)23(32-24)29-18-11-9-17(10-12-18)25(26,27)28/h5-12,19-20H,3-4,13-16H2,1-2H3,(H2,29,30,31,32)
InChiKey: DHUFCGXOEIPKPY-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
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Echinococcus granulosus	insulin growth factor 1 receptor beta	0.0047	0.0891	0.0864
Loa Loa (eye worm)	alpha-tubulin	0.0173	0.4083	0.7426
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0229	0.5498	1
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.004	0.0694	0.0665
Echinococcus multilocularis	mitogen activated protein kinase 3	0.0051	0.0974	0.0947
Trypanosoma brucei	tubulin gamma chain	0.0124	0.2837	0.5159
Trypanosoma brucei	tubulin delta chain	0.0054	0.1056	0.1921
Leishmania major	gamma-tubulin	0.0124	0.2837	0.5159
Trichomonas vaginalis	CMGC family protein kinase	0.0051	0.0974	0.0463
Brugia malayi	Receptor family ligand binding region containing protein	0.0014	0.0051	0.0093
Loa Loa (eye worm)	receptor family ligand binding region containing protein	0.0013	0.003	0.0055
Brugia malayi	Tubulin alpha-2 chain	0.0173	0.4083	0.7426
Schistosoma mansoni	tubulin subunit alpha	0.0054	0.1056	0.1029
Plasmodium vivax	tubulin epsilon chain, putative	0.0124	0.2837	0.49
Leishmania major	beta tubulin	0.0229	0.5498	1
Loa Loa (eye worm)	hypothetical protein	0.0098	0.2172	0.395
Loa Loa (eye worm)	BEN-1 protein	0.0229	0.5498	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0034	0.0549	0.0998
Echinococcus multilocularis	cpg binding protein	0.003	0.0455	0.0426
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0173	0.4083	0.7016
Echinococcus granulosus	Tubulin beta 2C chain	0.0229	0.5498	0.5485
Echinococcus multilocularis	expressed conserved protein	0.0092	0.2021	0.1997
Schistosoma mansoni	glutamate receptor kainate	0.0026	0.0353	0.0324
Trichomonas vaginalis	tubulin, putative	0.007	0.147	0.1509
Leishmania major	zeta tubulin, putative	0.0054	0.1056	0.1921
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0088	0.0159
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0054	0.1056	0.0635
Echinococcus multilocularis	Tubulin beta 2C chain	0.0229	0.5498	0.5485
Loa Loa (eye worm)	BEN-1 protein	0.0229	0.5498	1
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0054	0.1056	0.1489
Echinococcus multilocularis	glutamate (NMDA) receptor subunit	0.022	0.5285	0.5271
Brugia malayi	metabotropic GABA-B receptor subtype 2	0.0013	0.003	0.0055
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Brugia malayi	Guanylyl cyclase protein 23	0.0014	0.0051	0.0093
Entamoeba histolytica	tubulin family protein	0.0229	0.5498	1
Onchocerca volvulus	Atrial natriuretic peptide receptor 3 homolog	0.0014	0.0051	0.0121
Loa Loa (eye worm)	hypothetical protein	0.0148	0.3455	0.6284
Leishmania major	beta tubulin	0.0229	0.5498	1
Loa Loa (eye worm)	tubulin alpha 2	0.0119	0.2717	0.4941
Schistosoma mansoni	glutamate receptor kainate	0.0026	0.0353	0.0324
Echinococcus granulosus	Tubulin alpha 1 chain	0.0173	0.4083	0.4065
Brugia malayi	tubulin alpha chain - mouse	0.0173	0.4083	0.7426
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0049	0.0947	0.1721
Loa Loa (eye worm)	tubulin alpha-3 chain	0.0103	0.2302	0.4188
Echinococcus granulosus	tubulin alpha 3 chain	0.0173	0.4083	0.4065
Trypanosoma brucei	alpha tubulin	0.0173	0.4083	0.7426
Trichomonas vaginalis	tubulin alpha chain, putative	0.007	0.147	0.1509
Loa Loa (eye worm)	hypothetical protein	0.0013	0.003	0.0055
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0173	0.4083	0.7016
Plasmodium vivax	tubulin alpha chain, putative	0.0173	0.4083	0.7288
Schistosoma mansoni	glutamate receptor NMDA	0.004	0.0694	0.0665
Trypanosoma cruzi	zeta tubulin, putative	0.0054	0.1056	0.1921
Loa Loa (eye worm)	glutamate receptor	0.0013	0.003	0.0055
Echinococcus multilocularis	tubulin gamma 1 chain	0.0124	0.2837	0.2815
Schistosoma mansoni	tubulin subunit gamma	0.0124	0.2837	0.2815
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0173	0.4083	0.4065
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0016	0.0088	0.0058
Giardia lamblia	Beta tubulin	0.0229	0.5498	1
Brugia malayi	Glutamate receptor 1 precursor	0.0026	0.0353	0.0643
Leishmania major	beta tubulin	0.0229	0.5498	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0229	0.5498	0.5485
Echinococcus granulosus	cpg binding protein	0.003	0.0455	0.0426
Schistosoma mansoni	tyrosine kinase	0.008	0.171	0.1685
Schistosoma mansoni	hypothetical protein	0.004	0.0717	0.0689
Schistosoma mansoni	glutamate receptor NMDA	0.022	0.5285	0.5271
Loa Loa (eye worm)	CMGC/MAPK/ERK1 protein kinase	0.0051	0.0974	0.1772
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0016	0.0088	0.0058
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0029	0.0414	0.0753
Schistosoma mansoni	cpg binding protein	0.003	0.0455	0.0426
Schistosoma mansoni	protein kinase	0.0014	0.0051	0.0021
Loa Loa (eye worm)	metabotropic GABA-B receptor subtype 2	0.0013	0.003	0.0055
Schistosoma mansoni	hypothetical protein	0.0406	1	1
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0098	0.2172	0.3916
Entamoeba histolytica	tubulin family protein	0.0229	0.5498	1
Loa Loa (eye worm)	hypothetical protein	0.0173	0.4083	0.7426
Echinococcus multilocularis	tubulin alpha	0.0124	0.2837	0.2815
Trichomonas vaginalis	tubulin beta chain, putative	0.0173	0.4083	0.7016
Echinococcus multilocularis	beta tubulin	0.0229	0.5498	0.5485
Leishmania major	delta tubulin, putative	0.0054	0.1056	0.1921
Echinococcus granulosus	tubulin alpha 1C chain	0.0173	0.4083	0.4065
Trypanosoma brucei	epsilon tubulin	0.0124	0.2837	0.5159
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0229	0.5498	1
Echinococcus multilocularis	tubulin alpha chain	0.0173	0.4083	0.4065
Loa Loa (eye worm)	RGC/RGC protein kinase	0.0014	0.0051	0.0093
Leishmania major	beta tubulin	0.0229	0.5498	1
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0049	0.0947	0.1721
Echinococcus multilocularis	Tubulin beta 2C chain	0.0229	0.5498	0.5485
Leishmania major	mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440	0.0051	0.0974	0.1772
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0051	0.0093
Giardia lamblia	Epsilon tubulin	0.0054	0.1056	0.0181
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0755	0.1373
Loa Loa (eye worm)	glutamate receptor 2	0.0026	0.0353	0.0643
Mycobacterium ulcerans	4'-phosphopantetheinyl transferase	0.0023	0.0279	0.2009
Schistosoma mansoni	tubulin subunit beta	0.0229	0.5498	0.5485
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.004	0.0694	0.0665
Echinococcus granulosus	L aminoadipate semialdehyde	0.0083	0.1786	0.1761
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0016	0.0088	0.0058
Mycobacterium tuberculosis	Probable glutamine-binding lipoprotein GlnH (GLNBP)	0.0067	0.1391	1
Brugia malayi	Tubulin alpha chain	0.0173	0.4083	0.7426
Trichomonas vaginalis	conserved hypothetical protein	0.0054	0.1056	0.0635
Schistosoma mansoni	hypothetical protein	0.0016	0.0088	0.0058
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 3	0.0093	0.2054	0.203
Echinococcus multilocularis	insulin receptor	0.0047	0.0891	0.0864
Toxoplasma gondii	CMGC kinase, MAPK family (ERK) MAPK-1	0.0051	0.0974	0.1332
Loa Loa (eye worm)	alpha-tubulin isotype 2	0.0119	0.2717	0.4941
Schistosoma mansoni	hypothetical protein	0.004	0.0717	0.0689
Echinococcus multilocularis	glutamate receptor subunit protein glur	0.0026	0.0353	0.0324
Brugia malayi	aminoadipate-semialdehyde dehydrogenase-phosphopantetheinyl transferase	0.0083	0.1786	0.3248
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0051	0.0974	0.1772
Trichomonas vaginalis	tubulin beta chain, putative	0.0173	0.4083	0.7016
Echinococcus multilocularis	tubulin alpha chain	0.0173	0.4083	0.4065
Plasmodium falciparum	tubulin gamma chain	0.0124	0.2837	0.49
Echinococcus multilocularis	tubulin alpha 3 chain	0.0173	0.4083	0.4065
Schistosoma mansoni	hypothetical protein	0.0026	0.0353	0.0324
Brugia malayi	tubulin alpha-2 chain	0.0173	0.4083	0.7426
Brugia malayi	Metabotropic glutamate receptor precursor.	0.0013	0.003	0.0055
Schistosoma mansoni	tyrosine kinase	0.0079	0.1688	0.1663
Trichomonas vaginalis	tubulin gamma chain, putative	0.0229	0.5498	1
Trypanosoma cruzi	epsilon tubulin, putative	0.0124	0.2837	0.5159
Leishmania major	mitogen activated protein kinase, putative,map kinase, putative	0.0051	0.0974	0.1772
Trichomonas vaginalis	tubulin beta chain, putative	0.0229	0.5498	1
Toxoplasma gondii	alpha tubulin TUBA1	0.0173	0.4083	0.7288
Echinococcus granulosus	Protein patched homolog 1	0.0042	0.0755	0.0727
Echinococcus granulosus	tubulin delta chain	0.0054	0.1056	0.1029
Echinococcus granulosus	tubulin alpha 3 chain	0.0173	0.4083	0.4065
Schistosoma mansoni	aminoadipate-semialdehyde dehydrogenase	0.0083	0.1786	0.1761
Schistosoma mansoni	patched 1	0.0042	0.0755	0.0727
Echinococcus granulosus	glutamate receptor ionotrophic AMPA 3	0.004	0.0694	0.0665
Trichomonas vaginalis	CMGC family protein kinase	0.0051	0.0974	0.0463
Echinococcus granulosus	tubulin subunit TubB	0.0173	0.4083	0.4065
Leishmania major	beta tubulin	0.0229	0.5498	1
Echinococcus granulosus	expressed conserved protein	0.0092	0.2021	0.1997
Loa Loa (eye worm)	tubulin alpha chain	0.0173	0.4083	0.7426
Echinococcus granulosus	glutamate receptor ionotropic kainate	0.0026	0.0353	0.0324
Schistosoma mansoni	tyrosine kinase	0.0047	0.0891	0.0864
Loa Loa (eye worm)	RGC/RGC protein kinase	0.0014	0.0051	0.0093
Schistosoma mansoni	hypothetical protein	0.0051	0.0994	0.0966
Echinococcus multilocularis	tubulin alpha chain	0.0173	0.4083	0.4065
Loa Loa (eye worm)	tubulin beta-2A chain	0.0229	0.5498	1
Echinococcus multilocularis	L aminoadipate semialdehyde	0.0083	0.1786	0.1761
Echinococcus multilocularis	glutamate receptor, ionotrophic, AMPA 3	0.004	0.0694	0.0665
Schistosoma mansoni	hypothetical protein	0.0034	0.0549	0.052
Echinococcus multilocularis	tubulin alpha 1C chain	0.0173	0.4083	0.4065
Loa Loa (eye worm)	tubulin beta chain	0.0229	0.5498	1
Echinococcus granulosus	Niemann Pick C1 protein	0.014	0.3237	0.3216
Echinococcus granulosus	nmda type glutamate receptor	0.0093	0.2054	0.203
Trichomonas vaginalis	CMGC family protein kinase	0.0051	0.0974	0.0463
Trypanosoma cruzi	mitogen-activated protein kinase 11, putative	0.0051	0.0974	0.1772
Loa Loa (eye worm)	tubulin beta chain	0.0054	0.1056	0.1921
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0042	0.0755	0.1373
Trichomonas vaginalis	tubulin alpha chain, putative	0.007	0.147	0.1509
Echinococcus multilocularis	tubulin delta chain	0.0054	0.1056	0.1029
Trichomonas vaginalis	conserved hypothetical protein	0.0054	0.1056	0.0635
Echinococcus granulosus	geminin	0.0168	0.3961	0.3943
Echinococcus granulosus	tubulin epsilon chain	0.0124	0.2837	0.2815
Schistosoma mansoni	hypothetical protein	0.004	0.0717	0.0689
Plasmodium vivax	tubulin gamma chain, putative	0.0124	0.2837	0.49
Toxoplasma gondii	beta-tubulin, putative	0.0229	0.5498	1
Brugia malayi	Tubulin gamma chain	0.0124	0.2837	0.5159
Schistosoma mansoni	tubulin subunit beta	0.0229	0.5498	0.5485
Loa Loa (eye worm)	hypothetical protein	0.0013	0.003	0.0055
Echinococcus granulosus	glutamate receptor 2	0.004	0.0694	0.0665
Onchocerca volvulus		0.0083	0.1786	1
Echinococcus granulosus	Tubulin alpha 1 chain	0.0173	0.4083	0.4065
Loa Loa (eye worm)	tubulin alpha 2	0.0049	0.0936	0.1703
Schistosoma mansoni	serine/threonine protein kinase	0.0051	0.0974	0.0947
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.004	0.0694	0.0665
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Loa Loa (eye worm)	tubulin alpha 2	0.0119	0.2717	0.4941
Leishmania major	beta tubulin	0.0229	0.5498	1
Schistosoma mansoni	hypothetical protein	0.004	0.0717	0.0689
Brugia malayi	Latrophilin receptor protein 2	0.0016	0.0088	0.0159
Trichomonas vaginalis	tubulin, putative	0.007	0.147	0.1509
Schistosoma mansoni	alpha tubulin	0.0173	0.4083	0.4065
Brugia malayi	Tubulin beta-1 chain	0.0229	0.5498	1
Echinococcus multilocularis	GPCR, family 2	0.0016	0.0088	0.0058
Echinococcus granulosus	tubulin beta 1 chain	0.0229	0.5498	0.5485
Echinococcus granulosus	epidermal growth factor receptor	0.0148	0.3449	0.3429
Trypanosoma cruzi	zeta tubulin, putative	0.0054	0.1056	0.1921
Wolbachia endosymbiont of Brugia malayi	cell division protein FtsZ	0.0054	0.1056	1
Echinococcus granulosus	tubulin alpha chain	0.0173	0.4083	0.4065
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0549	0.0998
Echinococcus granulosus	Tubulin beta 2C chain	0.0229	0.5498	0.5485
Schistosoma mansoni	tyrosine kinase	0.0014	0.0051	0.0021
Leishmania major	beta tubulin	0.0229	0.5498	1
Plasmodium falciparum	alpha tubulin 1	0.0173	0.4083	0.7288
Schistosoma mansoni	tyrosine kinase	0.0079	0.1688	0.1663
Giardia lamblia	Delta tubulin	0.0054	0.1056	0.0181
Trypanosoma brucei	beta tubulin	0.0124	0.2837	0.5159
Echinococcus granulosus	Tubulin beta 2C chain	0.0229	0.5498	0.5485
Trypanosoma cruzi	beta tubulin, putative	0.0229	0.5498	1
Echinococcus multilocularis	Tubulin beta 2C chain	0.0229	0.5498	0.5485
Echinococcus granulosus	tubulin gamma 1 chain	0.0124	0.2837	0.2815
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Echinococcus multilocularis	Tubulin beta 2C chain	0.0229	0.5498	0.5485
Echinococcus granulosus	Ribosomal protein S1 RNA binding domain	0.0026	0.0353	0.0324
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0103	0.2302	0.3263
Brugia malayi	Receptor family ligand binding region containing protein	0.0013	0.003	0.0055
Echinococcus multilocularis	mitogen activated protein kinase	0.0051	0.0974	0.0947
Echinococcus multilocularis	Glutamate receptor, ionotropic kainate 2	0.004	0.0694	0.0665
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0229	0.5498	0.5485
Trichomonas vaginalis	tubulin, putative	0.0054	0.1056	0.0635
Echinococcus multilocularis	tubulin alpha chain	0.0173	0.4083	0.4065
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Brugia malayi	metabotropic glutamate receptor type 2	0.0013	0.003	0.0055
Echinococcus multilocularis	tubulin subunit TubB	0.0173	0.4083	0.4065
Schistosoma mansoni	glutamate receptor AMPA	0.0026	0.0353	0.0324
Toxoplasma gondii	beta-1 tubulin, putative	0.0229	0.5498	1
Echinococcus multilocularis	protein dispatched 1	0.0048	0.0905	0.0878
Schistosoma mansoni	cpg binding protein	0.003	0.0455	0.0426
Echinococcus granulosus	mitogen activated protein kinase 3	0.0051	0.0974	0.0947
Leishmania major	beta tubulin	0.0229	0.5498	1
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0016	0.0088	0.0159
Brugia malayi	Cell division protein ftsZ	0.0054	0.1056	0.1921
Trypanosoma cruzi	extracellular receptor, putative	0.0013	0.003	0.0055
Treponema pallidum	amino acid ABC transporter, periplasmic binding protein (hisJ)	0.0067	0.1391	1
Chlamydia trachomatis	glutamine binding protein	0.0067	0.1391	1
Plasmodium vivax	tubulin alpha chain, putative	0.0173	0.4083	0.7288
Brugia malayi	Glutamate receptor 2 precursor	0.0026	0.0353	0.0643
Schistosoma mansoni	tubulin subunit beta	0.0229	0.5498	0.5485
Trichomonas vaginalis	tubulin alpha chain, putative	0.0229	0.5498	1
Echinococcus granulosus	tubulin alpha chain	0.0173	0.4083	0.4065
Mycobacterium ulcerans	cell division protein FtsZ	0.0054	0.1056	0.7596
Onchocerca volvulus		0.0014	0.0051	0.0121
Loa Loa (eye worm)	RGC/RGC protein kinase	0.0014	0.0051	0.0093
Loa Loa (eye worm)	hypothetical protein	0.0083	0.1786	0.3248
Giardia lamblia	Alpha-tubulin	0.0173	0.4083	0.6872
Loa Loa (eye worm)	glutamate receptor 1	0.0026	0.0353	0.0643
Trypanosoma brucei	mitogen activated protein kinase 4, putative	0.0051	0.0974	0.1772
Loa Loa (eye worm)	hypothetical protein	0.0119	0.2717	0.4941
Echinococcus granulosus	tubulin subunit beta	0.0229	0.5498	0.5485
Brugia malayi	CXXC zinc finger family protein	0.0029	0.0414	0.0753
Schistosoma mansoni	tubulin subunit beta	0.0229	0.5498	0.5485
Trypanosoma cruzi	alpha tubulin, putative	0.0173	0.4083	0.7426
Trypanosoma brucei	alpha tubulin, putative	0.007	0.147	0.2674
Brugia malayi	beta-tubulin, identical	0.0229	0.5498	1
Echinococcus granulosus	tyrosine kinase	0.0014	0.0051	0.0021
Echinococcus granulosus	Niemann Pick C1 protein	0.0098	0.2172	0.2148
Echinococcus granulosus	tubulin alpha chain	0.0173	0.4083	0.4065
Plasmodium falciparum	tubulin delta chain, putative	0.0054	0.1056	0.1489
Echinococcus granulosus	insulin receptor	0.0047	0.0891	0.0864
Schistosoma mansoni	tubulin subunit alpha	0.0173	0.4083	0.4065
Echinococcus granulosus	tubulin alpha 1C chain	0.0173	0.4083	0.4065
Echinococcus multilocularis	tyrosine kinase	0.0014	0.0051	0.0021
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Loa Loa (eye worm)	hypothetical protein	0.0013	0.003	0.0055
Trichomonas vaginalis	tubulin gamma chain, putative	0.0124	0.2837	0.4389
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.007	0.147	0.1509
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0148	0.3449	0.6273
Echinococcus granulosus	glutamate NMDA receptor subunit	0.022	0.5285	0.5271
Echinococcus multilocularis	glutamate receptor ionotropic kainate	0.0026	0.0353	0.0324
Schistosoma mansoni	alpha tubulin	0.0173	0.4083	0.4065
Mycobacterium ulcerans	glutamine-binding lipoprotein GlnH	0.0067	0.1391	1
Echinococcus multilocularis	tubulin alpha 3 chain	0.0173	0.4083	0.4065
Echinococcus granulosus	glutamate receptor ionotropic kainate 3	0.0026	0.0353	0.0324
Schistosoma mansoni	tubulin subunit beta	0.0054	0.1056	0.1029
Echinococcus multilocularis	epidermal growth factor receptor	0.0148	0.3449	0.3429
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0049	0.0947	0.1721
Leishmania major	beta tubulin	0.0229	0.5498	1
Echinococcus multilocularis	glutamate receptor 2	0.0026	0.0353	0.0324
Echinococcus granulosus	melanoma receptor tyrosine protein kinase	0.008	0.171	0.1685
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0173	0.4083	0.4065
Schistosoma mansoni	glutamate receptor kainate	0.0026	0.0353	0.0324
Echinococcus multilocularis	tubulin alpha 1C chain	0.0173	0.4083	0.4065
Schistosoma mansoni	tubulin subunit epsilon	0.0124	0.2837	0.2815
Leishmania major	beta tubulin	0.0229	0.5498	1
Echinococcus granulosus	tubulin alpha chain	0.0173	0.4083	0.4065
Trypanosoma brucei	hypothetical protein, conserved	0.0023	0.0279	0.0508
Giardia lamblia	Gamma tubulin	0.0124	0.2837	0.4117
Schistosoma mansoni	hypothetical protein	0.0168	0.3961	0.3943
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0016	0.0088	0.0159
Echinococcus granulosus	Tubulin alpha 1 chain	0.0173	0.4083	0.4065
Loa Loa (eye worm)	hypothetical protein	0.0013	0.003	0.0055
Trypanosoma cruzi	tubulin delta chain	0.0054	0.1056	0.1921
Giardia lamblia	Beta tubulin	0.0229	0.5498	1
Trichomonas vaginalis	tubulin beta-1 chain, putative	0.0054	0.1056	0.0635
Echinococcus multilocularis	Ribosomal protein S1, RNA binding domain	0.0026	0.0353	0.0324
Leishmania major	beta tubulin	0.0229	0.5498	1
Loa Loa (eye worm)	hypothetical protein	0.0013	0.003	0.0055
Echinococcus granulosus	beta tubulin	0.0229	0.5498	0.5485
Entamoeba histolytica	tubulin gamma chain	0.0124	0.2837	0.5133
Echinococcus multilocularis	insulin growth factor 1 receptor beta	0.0047	0.0891	0.0864
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0054	0.1061	0.1499
Trypanosoma brucei	beta tubulin	0.0229	0.5498	1
Plasmodium falciparum	alpha tubulin 2	0.0173	0.4083	0.7288
Echinococcus multilocularis		0.0046	0.0854	0.0826
Trichomonas vaginalis	tubulin beta chain, putative	0.007	0.147	0.1509
Schistosoma mansoni	tubulin subunit alpha	0.0173	0.4083	0.4065
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Echinococcus granulosus	GPCR family 2	0.0016	0.0088	0.0058
Schistosoma mansoni	tyrosine kinase	0.0014	0.0051	0.0021
Trypanosoma brucei	epsilon tubulin	0.0124	0.2837	0.5159
Trypanosoma brucei	beta tubulin	0.0229	0.5498	1
Schistosoma mansoni	ATP-binding cassette transporter	0.0026	0.0353	0.0324
Leishmania major	beta tubulin	0.0229	0.5498	1
Echinococcus multilocularis	beta tubulin	0.0229	0.5498	0.5485
Trypanosoma cruzi	epsilon tubulin, putative	0.0124	0.2837	0.5159
Echinococcus multilocularis	geminin	0.0168	0.3961	0.3943
Echinococcus granulosus	sterol regulatory element binding protein	0.0042	0.0755	0.0727
Schistosoma mansoni	tubulin subunit delta	0.0054	0.1056	0.1029
Loa Loa (eye worm)	tubulin beta-4 chain	0.0229	0.5498	1
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.004	0.0694	0.0665
Echinococcus granulosus	Glutamate receptor ionotropic kainate 2	0.004	0.0694	0.0665
Loa Loa (eye worm)	hypothetical protein	0.0103	0.2302	0.4188
Echinococcus multilocularis	tubulin beta 1 chain	0.0229	0.5498	0.5485
Trypanosoma brucei	epsilon tubulin	0.0124	0.2837	0.5159
Echinococcus multilocularis	protein patched	0.0042	0.0755	0.0727
Chlamydia trachomatis	arginine ABC transporter substrate-binding protein ArtJ	0.0067	0.1391	1
Schistosoma mansoni	alpha tubulin	0.0173	0.4083	0.4065
Trypanosoma brucei	beta tubulin	0.0229	0.5498	1
Brugia malayi	Tubulin beta chain	0.007	0.147	0.2674
Brugia malayi	hypothetical protein	0.0013	0.003	0.0055
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0173	0.4083	0.7426
Brugia malayi	Muscleblind-like protein	0.0148	0.3455	0.6284
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0995	0.1809
Loa Loa (eye worm)	hypothetical protein	0.0013	0.003	0.0055
Trypanosoma brucei	alpha tubulin	0.0173	0.4083	0.7426
Echinococcus multilocularis	NMDA receptor	0.0026	0.0353	0.0324
Plasmodium falciparum	tubulin beta chain	0.0229	0.5498	1
Mycobacterium tuberculosis	Cell division protein FtsZ	0.0054	0.1056	0.6992
Onchocerca volvulus		0.0029	0.0414	0.2186
Leishmania major	beta tubulin	0.0229	0.5498	1
Brugia malayi	Niemann-Pick C1 protein precursor	0.0098	0.2172	0.395
Trypanosoma brucei	zeta tubulin, putative	0.0054	0.1056	0.1921
Brugia malayi	MAP kinase sur-1	0.0051	0.0974	0.1772
Treponema pallidum	amino acid ABC transporter, periplasmic binding protein	0.0067	0.1391	1
Trypanosoma cruzi	tubulin gamma chain	0.0124	0.2837	0.5159
Echinococcus granulosus	glutamate receptor subunit protein glur	0.0026	0.0353	0.0324
Loa Loa (eye worm)	tubulin beta-1 chain	0.0229	0.5498	1
Echinococcus multilocularis	Niemann Pick C1 protein	0.014	0.3237	0.3216
Trichomonas vaginalis	tubulin beta chain, putative	0.0173	0.4083	0.7016
Schistosoma mansoni	tubulin subunit beta	0.0229	0.5498	0.5485
Brugia malayi	Furin-like cysteine rich region family protein	0.0148	0.3449	0.6273
Echinococcus multilocularis	hypothetical protein	0.0173	0.4083	0.4065
Plasmodium vivax	delta tubulin, putative	0.0054	0.1056	0.1489
Echinococcus granulosus	tubulin alpha chain	0.0173	0.4083	0.4065
Trichomonas vaginalis	CMGC family protein kinase	0.0051	0.0974	0.0463
Plasmodium falciparum	tubulin epsilon chain, putative	0.0124	0.2837	0.49
Trypanosoma brucei	zeta tubulin	0.0054	0.1056	0.1921
Onchocerca volvulus		0.007	0.147	0.8205
Echinococcus multilocularis	peroxisome assembly protein 26	0.0173	0.4083	0.4065
Schistosoma mansoni	hypothetical protein	0.0016	0.0088	0.0058
Schistosoma mansoni	glutamate receptor AMPA	0.0026	0.0353	0.0324
Echinococcus granulosus	epidermal growth factor receptor	0.008	0.171	0.1685
Loa Loa (eye worm)	TK/INSR protein kinase	0.0047	0.0891	0.1621
Schistosoma mansoni	tubulin subunit alpha	0.0173	0.4083	0.4065
Trichomonas vaginalis	tubulin alpha chain, putative	0.007	0.147	0.1509
Loa Loa (eye worm)	tubulin gamma chain	0.0124	0.2837	0.5159
Echinococcus multilocularis	dnaJ subfamily B	0.0406	1	1
Trypanosoma cruzi	mitogen activated protein kinase 4, putative	0.0051	0.0974	0.1772
Schistosoma mansoni	tyrosine kinase	0.0079	0.1688	0.1663
Echinococcus granulosus	Tubulin beta 2C chain	0.0229	0.5498	0.5485
Loa Loa (eye worm)	beta-tubulin	0.0229	0.5498	1
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Loa Loa (eye worm)	hypothetical protein	0.0013	0.003	0.0055
Trichomonas vaginalis	tubulin beta chain, putative	0.0173	0.4083	0.7016
Echinococcus granulosus	peroxisome assembly protein 26	0.0173	0.4083	0.4065
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0124	0.2837	0.49
Leishmania major	beta tubulin	0.0229	0.5498	1
Entamoeba histolytica	hypothetical protein	0.0023	0.0279	0.0456
Schistosoma mansoni	hypothetical protein	0.0016	0.0088	0.0058
Treponema pallidum	cell division protein FtsZ	0.0054	0.1056	0.6992
Echinococcus multilocularis	epidermal growth factor receptor	0.008	0.171	0.1685
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0119	0.2717	0.4136
Brugia malayi	Tubulin beta chain	0.0054	0.1056	0.1921
Echinococcus multilocularis	sterol regulatory element binding protein	0.0042	0.0755	0.0727
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0947	0.1721
Echinococcus granulosus	alpha tubulin	0.0173	0.4083	0.4065
Giardia lamblia	Alpha-tubulin	0.0173	0.4083	0.6872
Loa Loa (eye worm)	alpha-tubulin	0.0173	0.4083	0.7426
Loa Loa (eye worm)	metabotropic glutamate receptor 8	0.0013	0.003	0.0055
Mycobacterium leprae	cell division protein FtsZ	0.0054	0.1056	1
Loa Loa (eye worm)	hypothetical protein	0.0013	0.003	0.0055
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Toxoplasma gondii	alpha-tubulin I, putative	0.0173	0.4083	0.7288
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.006	0.1225	0.1199
Schistosoma mansoni	hypothetical protein	0.0016	0.0088	0.0058
Schistosoma mansoni	tubulin subunit beta	0.0229	0.5498	0.5485
Leishmania major	alpha tubulin	0.0173	0.4083	0.7426
Echinococcus multilocularis	nmda type glutamate receptor	0.0093	0.2054	0.203
Echinococcus multilocularis	receptor type guanylyl cyclase	0.0014	0.0051	0.0021
Echinococcus multilocularis	tubulin subunit beta	0.0229	0.5498	0.5485
Echinococcus granulosus	Tubulin beta 2C chain	0.0229	0.5498	0.5485
Brugia malayi	Tubulin alpha-2 chain	0.0173	0.4083	0.7426
Giardia lamblia	Beta tubulin	0.0229	0.5498	1
Echinococcus granulosus	tubulin alpha	0.0124	0.2837	0.2815
Echinococcus multilocularis	tubulin epsilon chain	0.0124	0.2837	0.2815
Trypanosoma cruzi	mitogen activated protein kinase 2, putative	0.0051	0.0974	0.1772
Leishmania major	phosphopantetheinyl transferase-like protein	0.0023	0.0279	0.0508
Leishmania major	beta tubulin	0.0229	0.5498	1
Trypanosoma brucei	protein kinase, putative	0.0051	0.0974	0.1772
Trichomonas vaginalis	tubulin, putative	0.0229	0.5498	1
Trichomonas vaginalis	tubulin gamma chain, putative	0.0124	0.2837	0.4389
Leishmania major	beta tubulin	0.0229	0.5498	1
Echinococcus multilocularis	Niemann Pick C1 protein	0.0098	0.2172	0.2148
Echinococcus granulosus	tubulin beta 4A class IVa	0.0229	0.5498	0.5485
Trichomonas vaginalis	tubulin alpha chain, putative	0.0124	0.2837	0.4389
Echinococcus multilocularis	tubulin alpha chain	0.0173	0.4083	0.4065
Leishmania major	epsilon tubulin, putative	0.0124	0.2837	0.5159
Echinococcus multilocularis	muscleblind protein	0.0148	0.3455	0.3436
Mycobacterium ulcerans	phosphopantetheinyl transferase, PptII	0.0023	0.0279	0.2009
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0054	0.1056	0.1489
Echinococcus multilocularis	muscleblind protein 1	0.0148	0.3455	0.3436
Schistosoma mansoni	hypothetical protein	0.0168	0.3961	0.3943
Entamoeba histolytica	tubulin alpha chain, putative	0.0173	0.4083	0.7412
Leishmania major	extracellular receptor, putative	0.0013	0.003	0.0055
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0016	0.0088	0.0058
Schistosoma mansoni	tyrosine kinase	0.0047	0.0891	0.0864
Schistosoma mansoni	tyrosine kinase	0.0148	0.3449	0.3429
Leishmania major	beta tubulin	0.0229	0.5498	1
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0173	0.4083	0.7016
Leishmania major	beta tubulin	0.0229	0.5498	1
Loa Loa (eye worm)	hypothetical protein	0.0148	0.3455	0.6284
Echinococcus granulosus	muscleblind protein	0.0148	0.3455	0.3436
Schistosoma mansoni	cpg binding protein	0.0029	0.0414	0.0385
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0099	0.221	0.2186
Trichomonas vaginalis	tubulin beta chain, putative	0.0173	0.4083	0.7016
Schistosoma mansoni	tyrosine kinase	0.008	0.171	0.1685
Echinococcus granulosus	receptor type guanylyl cyclase	0.0014	0.0051	0.0021
Echinococcus granulosus	beta tubulin	0.0229	0.5498	0.5485
Trypanosoma brucei	alpha tubulin	0.0173	0.4083	0.7426
Toxoplasma gondii	beta tubulin	0.0229	0.5498	1
Trypanosoma cruzi	tubulin delta chain	0.0054	0.1056	0.1921
Echinococcus multilocularis	glutamate receptor 2	0.004	0.0694	0.0665
Brugia malayi	Protein kinase domain containing protein	0.0047	0.0891	0.1621
Loa Loa (eye worm)	tubulin alpha chain	0.0173	0.4083	0.7426
Trichomonas vaginalis	tubulin gamma chain, putative	0.0054	0.1056	0.0635
Trypanosoma brucei	beta tubulin	0.0229	0.5498	1
Entamoeba histolytica	tubulin alpha-1 chain	0.0173	0.4083	0.7412
Trichomonas vaginalis	tubulin beta chain, putative	0.0173	0.4083	0.7016
Brugia malayi	alpha-tubulin	0.0173	0.4083	0.7426
Brugia malayi	Tubulin alpha chain	0.0054	0.1056	0.1921
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0173	0.4083	0.4065
Trypanosoma brucei	alpha tubulin	0.0173	0.4083	0.7426
Brugia malayi	CHE-14 protein	0.0042	0.0755	0.1373
Plasmodium vivax	tubulin beta chain, putative	0.0229	0.5498	1
Echinococcus granulosus	mitogen activated protein kinase	0.0051	0.0974	0.0947

Activities

Activity type	Activity value	Assay description	Source	Reference
MST (functional)	ND 0 day	Antimalarial effect measured against trophozoite induced P. berghei in mice at dosage of 640 mg/kg after sc administration	ChEMBL.	7009867
MST (functional)	ND 0 day	Antimalarial effect measured in trophozoite induced P. berghei mice at dose of 320 mg/kg after sc administration.	ChEMBL.	7009867
MST (functional)	ND 0 day	Antimalarial effect against trophozoite-induced Plasmodium berghei in mice.	ChEMBL.	7009867
MST (functional)	= 0.3 day	Antimalarial effect of the compound was measured against trophozoite induced Plasmodium berghei in mice at dosage of 20 mg/kg after subcutaneous administration.	ChEMBL.	7009867
MST (functional)	= 0.3 day	Antimalarial effect of the compound was measured against trophozoite induced Plasmodium berghei in mice at dosage of 20 mg/kg after subcutaneous administration.	ChEMBL.	7009867
MST (functional)	= 0.5 day	Antimalarial effect of the compound was measured against trophozoite induced Plasmodium berghei in mice after subcutaneous administration at 40 mg/kg	ChEMBL.	7009867
MST (functional)	= 0.5 day	Antimalarial effect of the compound was measured against trophozoite induced Plasmodium berghei in mice at dosage of 20 mg/kg after subcutaneous administration.	ChEMBL.	7009867
MST (functional)	= 0.5 day	Antimalarial effect measured in trophozoite induced P. berghei mice at dose of 80 mg/kg after sc administration.	ChEMBL.	7009867
MST (functional)	= 0.5 day	Antimalarial effect of the compound was measured against trophozoite induced Plasmodium berghei in mice after subcutaneous administration at 40 mg/kg	ChEMBL.	7009867
MST (functional)	= 0.5 day	Antimalarial effect of the compound was measured against trophozoite induced Plasmodium berghei in mice at dosage of 20 mg/kg after subcutaneous administration.	ChEMBL.	7009867
MST (functional)	= 0.5 day	Antimalarial effect measured in trophozoite induced P. berghei mice at dose of 80 mg/kg after sc administration.	ChEMBL.	7009867
MST (functional)	= 0.7 day	Antimalarial effect measured in trophozoite induced P. berghei mice at dose of 80 mg/kg after sc administration.	ChEMBL.	7009867
MST (functional)	= 0.7 day	Antimalarial effect measured in trophozoite induced P. berghei mice at dose of 80 mg/kg after sc administration.	ChEMBL.	7009867
MST (functional)	= 9.5 day	Antimalarial effect against trophozoite induced Plasmodium berghei in mice at dosage of 160 mg/kg after subcutaneous administration.	ChEMBL.	7009867
MST (functional)	= 9.5 day	Antimalarial effect against trophozoite induced Plasmodium berghei in mice at dosage of 160 mg/kg after subcutaneous administration.	ChEMBL.	7009867
MST (functional)	= 9.7 day	Antimalarial effect against trophozoite induced Plasmodium berghei in mice at dosage of 160 mg/kg after subcutaneous administration.	ChEMBL.	7009867
MST (functional)	= 9.7 day	Antimalarial effect against trophozoite induced Plasmodium berghei in mice at dosage of 160 mg/kg after subcutaneous administration.	ChEMBL.	7009867
No. of survivals (functional)	2	Number of mice cured at a dose of 640 mg/kg sc	ChEMBL.	7009867
No. of survivals (functional)	3	Number of mice cured at a dose of 640 mg/kg sc	ChEMBL.	7009867
No. of survivals (functional)	5	Number of mice cured at a subcutaneous dose of 320 mg/kg.	ChEMBL.	7009867
No. of survivals (functional)	2	Number of mice cured at a dose of 640 mg/kg sc	ChEMBL.	7009867
No. of survivals (functional)	3	Number of mice cured at a dose of 640 mg/kg sc	ChEMBL.	7009867
No. of survivals (functional)	5	Number of mice cured at a subcutaneous dose of 320 mg/kg.	ChEMBL.	7009867
Ratio (functional)	ND 0	The ratio of SD90 of the quinine hydrocloride, to the SD90 of the test substance for the Dose of mg/kg	ChEMBL.	7009867

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: CHEMBL29267

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 39731