TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 499.091 | Formula: C27H39ClN6O
H donors: 2 H acceptors: 2 LogP: 6.04 Rotable bonds: 14
Rule of 5 violations (Lipinski): 1
SMILES: CCOc1ccc(cc1CN(CC)CC)Nc1nc(NCCN(CC)CC)c2c(n1)cc(cc2)Cl
InChi: 1S/C27H39ClN6O/c1-6-33(7-2)16-15-29-26-23-13-11-21(28)18-24(23)31-27(32-26)30-22-12-14-25(35-10-5)20(17-22)19-34(8-3)9-4/h11-14,17-18H,6-10,15-16,19H2,1-5H3,(H2,29,30,31,32)
InChiKey: YEHDUFLSTOLNLS-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
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Echinococcus granulosus	glycine receptor subunit beta	0.0175	0.3356	0.5711
Brugia malayi	Nuclear hormone receptor-like 1	0.0028	0.0137	0.0199
Wolbachia endosymbiont of Brugia malayi	ATP-dependent protease peptidase subunit	0.0022	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0137	0.0137
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Onchocerca volvulus		0.0094	0.1587	0.4729
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0175	0.3356	0.4883
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0028	0.0137	0.0233
Echinococcus granulosus	glycine receptor subunit beta	0.0175	0.3356	0.5711
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Echinococcus multilocularis	gamma aminobutyric acid receptor subunit	0.0081	0.129	0.2195
Schistosoma mansoni	acetylcholine receptor-related	0.0081	0.129	0.2195
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0175	0.3356	0.5711
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0028	0.0137	0.0137
Echinococcus granulosus	nicotinic acetylcholine receptor subunit type	0.0175	0.3356	0.5711
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0175	0.3356	0.5711
Loa Loa (eye worm)	hypothetical protein	0.0094	0.1587	0.1587
Onchocerca volvulus		0.0028	0.0127	0.0377
Brugia malayi	steroid hormone receptor	0.0028	0.0137	0.0199
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0028	0.0137	0.0233
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0028	0.0137	0.0233
Schistosoma mansoni	nAChR subunit	0.0175	0.3356	0.5711
Brugia malayi	gamma-aminobutyric-acid receptor beta subunit precursor	0.0335	0.6874	1
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Toxoplasma gondii	proteasome subunit beta type, putative	0.029	0.5877	1
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Echinococcus multilocularis	Bromodomain containing protein	0.0032	0.0234	0.0398
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0028	0.0137	0.0233
Loa Loa (eye worm)	intermediate filament protein	0.0028	0.0127	0.0127
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0081	0.129	0.1877
Schistosoma mansoni	coup transcription factor	0.0028	0.0137	0.0233
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Plasmodium vivax	proteasome subunit beta type-5, putative	0.029	0.5877	1
Schistosoma mansoni	neurotransmitter gated ion channel	0.0094	0.1587	0.27
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0137	0.0137
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0175	0.3356	0.5711
Echinococcus granulosus	nicotinic acetylcholine receptor a11 subunit	0.0175	0.3356	0.5711
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0028	0.0137	0.0199
Echinococcus granulosus	ecdysone induced protein 78C	0.0028	0.0137	0.0233
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0028	0.0137	0.0137
Schistosoma mansoni	nAChR subunit	0.0175	0.3356	0.5711
Brugia malayi	hypothetical protein	0.0081	0.129	0.1877
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0028	0.0137	0.0233
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0175	0.3356	0.5711
Trypanosoma brucei	proteasome subunit beta type-5, putative	0.029	0.5877	1
Onchocerca volvulus		0.0094	0.1587	0.4729
Schistosoma mansoni	thyroid hormone receptor	0.0028	0.0137	0.0233
Brugia malayi	Bromodomain containing protein	0.0073	0.1121	0.1631
Giardia lamblia	Kinase, putative	0.0032	0.0234	0.0398
Brugia malayi	Cation transporter family protein	0.0175	0.3356	0.4883
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0175	0.3356	0.5711
Schistosoma mansoni	nicotinic acetylcholine receptor alpha	0.0094	0.1587	0.27
Trichomonas vaginalis	bromodomain containing protein, putative	0.0032	0.0234	0.0398
Schistosoma mansoni	nAChR subunit	0.0081	0.129	0.2195
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0175	0.3356	0.4883
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Onchocerca volvulus	Putative nachr subunit	0.0175	0.3356	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0028	0.0137	0.0199
Schistosoma mansoni	neurotransmitter gated ion channel	0.0081	0.129	0.2195
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0094	0.1587	0.27
Trichomonas vaginalis	bromodomain-containing protein 4, brd4, putative	0.0032	0.0234	0.0398
Loa Loa (eye worm)	hypothetical protein	0.0094	0.1587	0.1587
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0028	0.0137	0.0408
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0028	0.0137	0.0233
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0081	0.129	0.1877
Entamoeba histolytica	bromodomain-containing protein	0.0032	0.0234	0.0398
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0028	0.0137	0.0199
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0028	0.0137	0.0137
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0175	0.3356	0.4883
Schistosoma mansoni	nAChR subunit	0.0175	0.3356	0.5711
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0028	0.0137	0.0199
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Echinococcus granulosus	acetylcholine receptor subunit beta 1	0.0175	0.3356	0.5711
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Schistosoma mansoni	proteasome catalytic subunit 3 (T01 family)	0.029	0.5877	1
Giardia lamblia	Proteasome subunit beta type 5 precursor	0.029	0.5877	1
Echinococcus granulosus	nicotinic acetylcholine receptor beta 1 subunit	0.0175	0.3356	0.5711
Trichomonas vaginalis	histone acetyltransferase gcn5, putative	0.0032	0.0234	0.0398
Echinococcus multilocularis	glycine receptor subunit beta	0.0175	0.3356	0.5711
Schistosoma mansoni	nuclear hormone receptor	0.0028	0.0137	0.0233
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0028	0.0137	0.0137
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0028	0.0137	0.0233
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Brugia malayi	nicotinic acetylcholine receptor alpha subunit, putative	0.0175	0.3356	0.4883
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Brugia malayi	ecdysteroid receptor	0.0028	0.0137	0.0199
Plasmodium falciparum	proteasome subunit beta type-5	0.029	0.5877	1
Schistosoma mansoni	nAChR subunit	0.0175	0.3356	0.5711
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0028	0.0137	0.0233
Loa Loa (eye worm)	hypothetical protein	0.0094	0.1587	0.1587
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0028	0.0137	0.0199
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0045	0.0514	0.0875
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0081	0.129	0.129
Loa Loa (eye worm)	hypothetical protein	0.0094	0.1587	0.1587
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0175	0.3356	0.4883
Loa Loa (eye worm)	proteasome A-type and B-type family protein	0.029	0.5877	0.5877
Onchocerca volvulus		0.0028	0.0137	0.0408
Brugia malayi	acetylcholine receptor alpha subunit precursor, putative	0.0175	0.3356	0.4883
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0028	0.0137	0.0233
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Onchocerca volvulus		0.0028	0.0127	0.0377
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0137	0.0137
Brugia malayi	hypothetical protein	0.0028	0.0127	0.0185
Echinococcus multilocularis	acetylcholine receptor subunit beta 1	0.0175	0.3356	0.5711
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit alpha 8	0.0175	0.3356	0.5711
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Loa Loa (eye worm)	LGC-31 protein	0.0175	0.3356	0.3356
Echinococcus multilocularis	nicotinic acetylcholine receptor beta 1 subunit	0.0175	0.3356	0.5711
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0028	0.0137	0.0233
Schistosoma mansoni	RAR-like nuclear receptor	0.0028	0.0137	0.0233
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0175	0.3356	0.5711
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0175	0.3356	0.5711
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0028	0.0137	0.0199
Schistosoma mansoni	bromodomain-containing protein 3 brd3	0.0073	0.1121	0.1907
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0028	0.0137	0.0233
Echinococcus multilocularis	lamin dm0	0.0028	0.0127	0.0215
Loa Loa (eye worm)	ACC-1 protein	0.0175	0.3356	0.3356
Mycobacterium leprae	proteasome (beta subunit) PrcB	0.029	0.5877	1
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0028	0.0137	0.0199
Loa Loa (eye worm)	neuronal acetylcholine receptor protein	0.0081	0.129	0.129
Echinococcus granulosus	gamma aminobutyric acid receptor subunit	0.0081	0.129	0.2195
Echinococcus multilocularis	neuronal acetylcholine receptor subunit alpha 4	0.0175	0.3356	0.5711
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0028	0.0137	0.0233
Echinococcus multilocularis	nicotinic acetylcholine receptor alpha subunit	0.0175	0.3356	0.5711
Brugia malayi	hypothetical protein	0.0081	0.129	0.1877
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0045	0.0514	0.0875
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0028	0.0137	0.0233
Mycobacterium ulcerans	proteasome PrcB	0.029	0.5877	1
Brugia malayi	Cation transporter family protein	0.0175	0.3356	0.4883
Echinococcus multilocularis	bromodomain containing 2	0.0073	0.1121	0.1907
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0028	0.0137	0.0137
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0175	0.3356	0.4883
Loa Loa (eye worm)	ACC-1 protein	0.0175	0.3356	0.3356
Onchocerca volvulus	Bile acid receptor homolog	0.0028	0.0137	0.0408
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Trichomonas vaginalis	bromodomain containing protein, putative	0.0045	0.0514	0.0875
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0028	0.0137	0.0199
Echinococcus multilocularis	Cys loop ligand gated ion channel subunit	0.0081	0.129	0.2195
Onchocerca volvulus		0.0175	0.3356	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0028	0.0137	0.0199
Brugia malayi	Neuronal acetylcholine receptor protein, alpha-2 chain precursor	0.0081	0.129	0.1877
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0081	0.129	0.2195
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0137	0.0137
Loa Loa (eye worm)	nicotinic acetylcholine receptor alpha subunit	0.0175	0.3356	0.3356
Brugia malayi	acetylcholine receptor protein, alpha-like chain, putative	0.0175	0.3356	0.4883
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0175	0.3356	0.4883
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0028	0.0137	0.0233
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0175	0.3356	0.4883
Loa Loa (eye worm)	hypothetical protein	0.0254	0.5104	0.5104
Brugia malayi	Acetylcholine receptor protein, alpha-like chain 1 precursor	0.0081	0.129	0.1877
Brugia malayi	nuclear receptor NHR-88	0.0028	0.0137	0.0199
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0028	0.0137	0.0233
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0175	0.3356	0.4883
Schistosoma mansoni	acetylcholine receptor subunit beta	0.0081	0.129	0.2195
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0028	0.0137	0.0199
Loa Loa (eye worm)	acetylcholine receptor protein	0.0081	0.129	0.129
Loa Loa (eye worm)	GABA receptor subunit	0.0094	0.1587	0.1587
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0028	0.0137	0.0233
Echinococcus multilocularis	glycine receptor subunit beta	0.0175	0.3356	0.5711
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0175	0.3356	0.4883
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0028	0.0137	0.0137
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0073	0.1121	0.1907
Loa Loa (eye worm)	hypothetical protein	0.0094	0.1587	0.1587
Echinococcus granulosus	Cys loop ligand gated ion channel subunit	0.0175	0.3356	0.5711
Loa Loa (eye worm)	excitatory GABA receptor EXP-1A	0.0175	0.3356	0.3356
Schistosoma mansoni	nAChR subunit	0.0175	0.3356	0.5711
Schistosoma mansoni	lamin	0.0028	0.0127	0.0215
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0234	0.0398
Onchocerca volvulus		0.0175	0.3356	1
Echinococcus granulosus	proteasome prosome macropain	0.029	0.5877	1
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Echinococcus multilocularis	nAChR subunit	0.0175	0.3356	0.5711
Onchocerca volvulus		0.0175	0.3356	1
Trichomonas vaginalis	conserved hypothetical protein	0.0045	0.0514	0.0875
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0094	0.1587	0.2309
Schistosoma mansoni	Cys-loop ligand gated ion channel subunit	0.0175	0.3356	0.5711
Trypanosoma cruzi	proteasome subunit beta type-5, putative	0.029	0.5877	1
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Loa Loa (eye worm)	nicotinic acetylcholine receptor non-alpha subunit	0.0175	0.3356	0.3356
Loa Loa (eye worm)	glutamate-gated chloride channel alpha3A subunit	0.0175	0.3356	0.3356
Brugia malayi	photoreceptor-specific nuclear receptor	0.0028	0.0137	0.0199
Onchocerca volvulus		0.0081	0.129	0.3844
Onchocerca volvulus		0.0175	0.3356	1
Trypanosoma cruzi	proteasome subunit beta type-5, putative	0.029	0.5877	1
Echinococcus multilocularis	FTZ F1 alpha	0.0028	0.0137	0.0233
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0137	0.0137
Echinococcus granulosus	nAChR subunit	0.0175	0.3356	0.5711
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Schistosoma mansoni	retinoic acid receptor RXR	0.0028	0.0137	0.0233
Echinococcus multilocularis	nicotinic acetylcholine receptor a11 subunit	0.0175	0.3356	0.5711
Loa Loa (eye worm)	hypothetical protein	0.0094	0.1587	0.1587
Brugia malayi	acetylcholine receptor, alpha-type subunit unc-38 precursor	0.0175	0.3356	0.4883
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0137	0.0137
Onchocerca volvulus		0.0175	0.3356	1
Brugia malayi	nicotinic acetylcholine receptor beta-1 chain precursor	0.0175	0.3356	0.4883
Brugia malayi	Proteasome A-type and B-type family protein	0.029	0.5877	0.8551
Brugia malayi	Cation transporter family protein	0.0175	0.3356	0.4883
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Toxoplasma gondii	bromodomain-containing protein	0.0032	0.0234	0.0398
Echinococcus granulosus	FTZ F1 alpha	0.0028	0.0137	0.0233
Leishmania major	proteasome beta 5 subunit, putative	0.029	0.5877	1
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0175	0.3356	0.4883
Schistosoma mansoni	nAChR subunit	0.0175	0.3356	0.5711
Echinococcus granulosus	glycine receptor subunit alpha 1	0.0175	0.3356	0.5711
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0028	0.0137	0.0233
Brugia malayi	nuclear hormone receptor	0.0028	0.0137	0.0199
Echinococcus granulosus	nicotinic acetylcholine receptor subunit alpha 8	0.0175	0.3356	0.5711
Echinococcus multilocularis	glycine receptor subunit alpha 1	0.0175	0.3356	0.5711
Brugia malayi	intermediate filament protein	0.0028	0.0127	0.0184
Echinococcus granulosus	nAChR subunit	0.0094	0.1587	0.27
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0028	0.0137	0.0199
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0045	0.0514	0.0875
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Onchocerca volvulus		0.0081	0.129	0.3844
Loa Loa (eye worm)	hypothetical protein	0.0094	0.1587	0.1587
Echinococcus granulosus	lamin dm0	0.0028	0.0127	0.0215
Loa Loa (eye worm)	hypothetical protein	0.0073	0.1121	0.1121
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Onchocerca volvulus		0.0175	0.3356	1
Loa Loa (eye worm)	ligand-Gated ion Channel family member	0.0175	0.3356	0.3356
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0028	0.0137	0.0233
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0028	0.0137	0.0199
Echinococcus granulosus	intermediate filament protein	0.0028	0.0127	0.0215
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.029	0.5877	1
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0081	0.129	0.1877
Schistosoma mansoni	nAChR subunit	0.0175	0.3356	0.5711
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Schistosoma mansoni	lamin	0.0028	0.0127	0.0215
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0028	0.0137	0.0199
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Brugia malayi	Neurotransmitter-gated ion-channel transmembrane region family protein	0.0094	0.1587	0.2309
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Brugia malayi	hypothetical protein	0.0081	0.129	0.1877
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Entamoeba histolytica	proteasome subunit beta type 5 precursor, putative	0.029	0.5877	1
Brugia malayi	hypothetical protein	0.0081	0.129	0.1877
Schistosoma mansoni	thyroid hormone receptor	0.0028	0.0137	0.0233
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0137	0.0137
Schistosoma mansoni	neurotransmitter gated ion channel	0.0081	0.129	0.2195
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0137	0.0137
Loa Loa (eye worm)	hypothetical protein	0.0335	0.6874	0.6874
Echinococcus granulosus	bromodomain containing 2	0.0073	0.1121	0.1907
Brugia malayi	Hypothetical glycine receptor like protein T20B12.9 in chromosome III	0.0094	0.1587	0.2309
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0028	0.0137	0.0137
Echinococcus multilocularis	proteasome (prosome, macropain)	0.029	0.5877	1
Brugia malayi	excitatory GABA receptor EXP-1A	0.0175	0.3356	0.4883
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0127	0.0127
Brugia malayi	glutamate-gated chloride channel alpha3A subunit, putative	0.0094	0.1587	0.2309
Schistosoma mansoni	nAChR subunit (ShAR1-alpha-like)	0.0175	0.3356	0.5711
Loa Loa (eye worm)	bromodomain containing protein	0.0032	0.0234	0.0234
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Schistosoma mansoni	intermediate filament proteins	0.0028	0.0127	0.0215
Mycobacterium tuberculosis	Proteasome beta subunit PrcB; assembles with alpha subunit PrcA.	0.029	0.5877	1
Echinococcus multilocularis	nicotinic acetylcholine receptor subunit type	0.0081	0.129	0.2195
Loa Loa (eye worm)	hypothetical protein	0.0175	0.3356	0.3356
Trichomonas vaginalis	conserved hypothetical protein	0.004	0.0408	0.0694
Loa Loa (eye worm)	acetylcholine receptor alpha subunit	0.0175	0.3356	0.3356
Entamoeba histolytica	hypothetical protein	0.0094	0.1587	0.27
Brugia malayi	hypothetical protein	0.0081	0.129	0.1877
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Entamoeba histolytica	bromodomain-containing protein	0.0032	0.0234	0.0398
Brugia malayi	Neurotransmitter-gated ion-channel ligand binding domain containing protein	0.0081	0.129	0.1877
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0073	0.1121	0.1907
Echinococcus granulosus	neuronal acetylcholine receptor subunit alpha 4	0.0175	0.3356	0.5711
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Echinococcus granulosus	nicotinic acetylcholine receptor alpha subunit	0.0175	0.3356	0.5711
Echinococcus multilocularis	lamin	0.0028	0.0127	0.0215
Echinococcus granulosus	lamin	0.0028	0.0127	0.0215
Loa Loa (eye worm)	steroid hormone receptor	0.0028	0.0137	0.0137
Schistosoma mansoni	nAChR subunit (ShAR1-beta2-like)	0.0175	0.3356	0.5711
Loa Loa (eye worm)	hypothetical protein	0.0081	0.129	0.129
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0028	0.0137	0.0233
Onchocerca volvulus	Protein ultraspiracle homolog	0.0028	0.0137	0.0408
Entamoeba histolytica	bromodomain-containing protein	0.0032	0.0234	0.0398
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0028	0.0127	0.0127
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0028	0.0137	0.0233
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Brugia malayi	Bromodomain containing protein	0.0073	0.1121	0.1631
Schistosoma mansoni	nAChR subunit	0.0081	0.129	0.2195
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0032	0.0234	0.0398
Onchocerca volvulus		0.0032	0.0234	0.0697
Schistosoma mansoni	nAChR subunit (ShAR1-beta-like)	0.0175	0.3356	0.5711
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0115	0.0115
Brugia malayi	Steroid receptor seven-up type 2	0.0028	0.0137	0.0199
Echinococcus multilocularis	nAChR subunit	0.0094	0.1587	0.27
Echinococcus multilocularis	ecdysone induced protein 78C	0.0028	0.0137	0.0233
Onchocerca volvulus		0.0081	0.129	0.3844
Echinococcus multilocularis	musashi	0.0028	0.0127	0.0215
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0028	0.0137	0.0233
Brugia malayi	Intermediate filament tail domain containing protein	0.0028	0.0127	0.0184
Loa Loa (eye worm)	hypothetical protein	0.0094	0.1587	0.1587

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)	0 day	Antimalarial effect measured against trophozoite induced Plasmodium berghei in mice at dosage of 80 mg/kg after sc administration; no data	ChEMBL.	7009867
MST (functional)	0 day	Antimalarial effect measured against trophozoite induced P. berghei in mice at dosage of 20 mg/kg after sc administration; no data	ChEMBL.	7009867
MST (functional)	= 0.6 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)	= 0.6 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)	= 0.8 day	Antimalarial effect against trophozoite induced Plasmodium berghei in mice at dosage of 160 mg/kg after subcutaneous administration.	ChEMBL.	7009867
MST (functional)	= 0.8 day	Antimalarial effect against trophozoite induced Plasmodium berghei in mice at dosage of 160 mg/kg after subcutaneous administration.	ChEMBL.	7009867
No. of toxic deaths (ADMET)	= 5	Number of toxic deaths at a dose of 640 mg/kg	ChEMBL.	7009867
No. of toxic deaths (ADMET)	= 5	Number of toxic deaths at a dose of 640 mg/kg	ChEMBL.	7009867
Ratio (functional)	< 2.5	The ratio of SD90 of the quinine hydrocloride, to the SD90 of the test substance for the Dose of >30 mg/kg	ChEMBL.	7009867
SD90 (functional)	> 30 mg kg-1 day-1	Antimalarial effect against trophozoite-induced Plasmodium berghei in mice.	ChEMBL.	7009867
SD90 (functional)	> 30 mg kg-1 day-1	Antimalarial effect against trophozoite-induced Plasmodium berghei in mice.	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: CHEMBL32034

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 40346