TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 271.354 | Formula: C17H21NO2
H donors: 0 H acceptors: 0 LogP: 1.75 Rotable bonds: 2
Rule of 5 violations (Lipinski): 1
SMILES: C1COC(O1)c1ccc(cc1)/C=C/1\CN2CCC1CC2
InChi: 1S/C17H21NO2/c1-3-15(17-19-9-10-20-17)4-2-13(1)11-16-12-18-7-5-14(16)6-8-18/h1-4,11,14,17H,5-10,12H2/b16-11+
InChiKey: XVNXKIXYFBYGNP-LFIBNONCSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Leishmania major	squalene synthase, putative	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania infantum	squalene synthase, putative	Get druggable targets OG5_129470	All targets in OG5_129470
Leishmania mexicana	farnesyltransferase, putative	Get druggable targets OG5_129470	All targets in OG5_129470
Leishmania braziliensis	squalene synthase, putative	Get druggable targets OG5_129470	All targets in OG5_129470
Candida albicans	squalene synthase similar to S. cerevisiae ERG9 (YHR190W) involved in ergosterol biosynthesis	Get druggable targets OG5_129470	All targets in OG5_129470
Trypanosoma cruzi	squalene synthase, putative	Get druggable targets OG5_129470	All targets in OG5_129470
Trypanosoma congolense	squalene synthase, putative	Get druggable targets OG5_129470	All targets in OG5_129470
Trypanosoma congolense	squalene synthase, putative	Get druggable targets OG5_129470	All targets in OG5_129470
Leishmania major	squalene synthase, putative	Get druggable targets OG5_129470	All targets in OG5_129470
Candida albicans	squalene synthase similar to S. cerevisiae ERG9 (YHR190W) involved in ergosterol biosynthesis	Get druggable targets OG5_129470	All targets in OG5_129470
Trypanosoma congolense	squalene synthase, putative	Get druggable targets OG5_129470	All targets in OG5_129470
Leishmania donovani	farnesyltransferase, putative	Get druggable targets OG5_129470	All targets in OG5_129470
Trypanosoma brucei	squalene synthase, putative	Get druggable targets OG5_129470	All targets in OG5_129470
Trypanosoma brucei gambiense	farnesyltransferase, putative,squalene synthase, putative	Get druggable targets OG5_129470	All targets in OG5_129470
Trypanosoma cruzi	squalene synthase, putative	Get druggable targets OG5_129470	All targets in OG5_129470

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
Trypanosoma brucei	squalene synthase, putative	0.0303	1	0.5
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0052	0.1358	0.1277
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0052	0.1358	0.1903
Brugia malayi	Animal haem peroxidase family protein	0.0218	0.7058	1
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0505	0.0716
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0052	0.1358	0.1843
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Onchocerca volvulus		0.0052	0.1358	0.1277
Echinococcus granulosus	biogenic amine 5HT receptor	0.0052	0.1358	0.1903
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0052	0.1358	0.1903
Schistosoma mansoni	opsin-like receptor	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Echinococcus multilocularis	neuropeptide Y receptor	0.0052	0.1358	0.1903
Schistosoma mansoni	biogenic amine receptor	0.0052	0.1358	0.1277
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0052	0.1358	0.1277
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0052	0.1358	0.1924
Brugia malayi	Serotonin receptor	0.0052	0.1358	0.1843
Brugia malayi	neuropeptide F receptor	0.0052	0.1358	0.1843
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Trypanosoma cruzi	squalene synthase, putative	0.0303	1	1
Echinococcus multilocularis	G protein coupled receptor 139	0.0052	0.1358	0.1903
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Trypanosoma brucei	squalene synthase, putative	0.0295602	0.5	0.5
Echinococcus granulosus	muscleblind protein	0.0157	0.4955	0.7013
Onchocerca volvulus		0.0052	0.1358	0.1277
Brugia malayi	hypothetical protein	0.0218	0.7058	1
Loa Loa (eye worm)	intermediate filament protein	0.0028	0.0523	0.0741
Brugia malayi	intermediate filament protein	0.0028	0.0523	0.0649
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0157	0.4955	0.702
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Onchocerca volvulus		0.0052	0.1358	0.1277
Echinococcus multilocularis	allatostatin A receptor	0.0052	0.1358	0.1903
Brugia malayi	Dopamine receptor protein 2	0.0052	0.1358	0.1843
Echinococcus granulosus	tm gpcr rhodopsin	0.0052	0.1358	0.1903
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0052	0.1358	0.1903
Brugia malayi	Serotonin receptor	0.0052	0.1358	0.1843
Echinococcus granulosus	somatostatin receptor	0.0052	0.1358	0.1903
Echinococcus granulosus	g-protein coupled receptor	0.0052	0.1358	0.1903
Onchocerca volvulus		0.0218	0.7058	1
Echinococcus granulosus	tm gpcr rhodopsin	0.0052	0.1358	0.1903
Brugia malayi	RE15519p	0.0052	0.1358	0.1843
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Mycobacterium ulcerans	phytoene synthase, CrtB	0.0094	0.2805	0.5
Brugia malayi	G-protein coupled receptor	0.0052	0.1358	0.1843
Trypanosoma cruzi	squalene synthase, putative	0.0295602	0.5	0.5
Echinococcus multilocularis	musashi	0.0028	0.0523	0.0718
Onchocerca volvulus	Peroxidasin homolog	0.0218	0.7058	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0052	0.1358	0.1277
Onchocerca volvulus		0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0052	0.1358	0.1924
Loa Loa (eye worm)	blistered cuticle protein 3	0.0218	0.7058	1
Echinococcus multilocularis	somatostatin receptor	0.0052	0.1358	0.1903
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Loa Loa (eye worm)	hypothetical protein	0.0157	0.4955	0.702
Loa Loa (eye worm)	melatonin receptor type 1A	0.0052	0.1358	0.1924
Echinococcus granulosus	intermediate filament protein	0.0028	0.0523	0.0718
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0052	0.1358	0.1843
Brugia malayi	follicle stimulating hormone receptor	0.0052	0.1358	0.1843
Echinococcus granulosus	g protein coupled receptor	0.0052	0.1358	0.1903
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0052	0.1358	0.1903
Echinococcus granulosus	peroxidasin	0.0218	0.7058	1
Brugia malayi	hypothetical protein	0.0052	0.1358	0.1843
Schistosoma mansoni	biogenic amine receptor	0.0052	0.1358	0.1277
Echinococcus multilocularis	lamin dm0	0.0028	0.0523	0.0718
Loa Loa (eye worm)	G-protein coupled receptor	0.0052	0.1358	0.1924
Echinococcus multilocularis	orexin receptor type 2	0.0052	0.1358	0.1903
Echinococcus multilocularis	g protein coupled receptor	0.0052	0.1358	0.1903
Onchocerca volvulus	Dual oxidase homolog	0.0218	0.7058	1
Brugia malayi	Peroxidasin	0.0218	0.7058	1
Loa Loa (eye worm)	animal heme peroxidase	0.0218	0.7058	1
Echinococcus granulosus	neuropeptide receptor	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Schistosoma mansoni	hypothetical protein	0.0052	0.1358	0.1277
Schistosoma mansoni	histamine h1 receptor	0.0052	0.1358	0.1277
Echinococcus granulosus	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Loa Loa (eye worm)	animal heme peroxidase	0.0218	0.7058	1
Brugia malayi	ORL1-like opioid receptor	0.0052	0.1358	0.1843
Brugia malayi	hypothetical protein	0.0052	0.1358	0.1843
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Loa Loa (eye worm)	G-protein coupled receptor	0.0052	0.1358	0.1924
Echinococcus multilocularis	dro:myosuppressin receptor	0.0052	0.1358	0.1903
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0052	0.1358	0.1903
Echinococcus granulosus	orexin receptor type 2	0.0052	0.1358	0.1903
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0052	0.1358	0.1903
Loa Loa (eye worm)	neuropeptide F receptor	0.0052	0.1358	0.1924
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Onchocerca volvulus	Peroxidasin homolog	0.0218	0.7058	1
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0052	0.1358	0.1903
Brugia malayi	sulfakinin receptor protein	0.0052	0.1358	0.1843
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0018	0.0025
Echinococcus multilocularis	Squalene phytoene synthase	0.0094	0.2805	0.3958
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Echinococcus multilocularis	muscleblind protein 1	0.0157	0.4955	0.7013
Brugia malayi	G protein-coupled receptor F59B2.13	0.0052	0.1358	0.1843
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Onchocerca volvulus		0.0052	0.1358	0.1277
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0015	0.007	0.0099
Echinococcus granulosus	fmrfamide receptor	0.0052	0.1358	0.1903
Brugia malayi	putative neuropeptide receptor NPR1	0.0052	0.1358	0.1843
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Onchocerca volvulus	Peroxidase homolog	0.0218	0.7058	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Brugia malayi	Blistered cuticle protein 3	0.0218	0.7058	1
Echinococcus multilocularis	serotonin receptor	0.0052	0.1358	0.1903
Echinococcus multilocularis	neuropeptide Y receptor	0.0052	0.1358	0.1903
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0052	0.1358	0.1924
Schistosoma mansoni	biogenic amine receptor	0.0052	0.1358	0.1277
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0028	0.0523	0.0741
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.0052	0.1358	0.1903
Onchocerca volvulus		0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Loa Loa (eye worm)	animal heme peroxidase	0.0218	0.7058	1
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0052	0.1358	0.1843
Echinococcus granulosus	hypothetical protein	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Echinococcus granulosus	7TM GPCR rhodopsin	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Brugia malayi	hypothetical protein	0.0052	0.1358	0.1843
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0052	0.1358	0.1903
Onchocerca volvulus		0.0052	0.1358	0.1277
Echinococcus granulosus	lamin	0.0028	0.0523	0.0718
Brugia malayi	Melatonin receptor type 1A	0.0052	0.1358	0.1843
Loa Loa (eye worm)	hypothetical protein	0.0189	0.6083	0.8618
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0052	0.1358	0.1843
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0052	0.1358	0.1277
Echinococcus multilocularis	fmrfamide receptor	0.0052	0.1358	0.1903
Schistosoma mansoni	amine GPCR	0.0052	0.1358	0.1277
Brugia malayi	AKH receptor	0.0052	0.1358	0.1843
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Brugia malayi	hypothetical protein	0.0052	0.1358	0.1843
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0052	0.1358	0.1277
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Echinococcus multilocularis	g protein coupled receptor	0.0052	0.1358	0.1903
Echinococcus granulosus	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Echinococcus multilocularis	g-protein coupled receptor	0.0052	0.1358	0.1903
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Onchocerca volvulus		0.0052	0.1358	0.1277
Brugia malayi	Intermediate filament tail domain containing protein	0.0028	0.0523	0.0649
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0052	0.1358	0.1903
Schistosoma mansoni	neuropeptide receptor	0.0052	0.1358	0.1277
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0052	0.1358	0.1277
Brugia malayi	hypothetical protein	0.0052	0.1358	0.1843
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0052	0.1358	0.1924
Schistosoma mansoni	peroxidasin	0.0218	0.7058	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Onchocerca volvulus	NADH dehydrogenase (ubiquinone) complex I, assembly factor 6 homolog	0.0094	0.2805	0.3491
Echinococcus multilocularis	neuropeptide receptor	0.0052	0.1358	0.1903
Onchocerca volvulus	Rap guanine nucleotide exchange factor 1 homolog	0.0189	0.6083	0.8507
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Onchocerca volvulus		0.0218	0.7058	1
Brugia malayi	Animal haem peroxidase family protein	0.0218	0.7058	1
Brugia malayi	N-terminal motif family protein	0.0189	0.6083	0.8604
Echinococcus granulosus	dro:myosuppressin receptor	0.0052	0.1358	0.1903
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Echinococcus granulosus	G protein coupled receptor 139	0.0052	0.1358	0.1903
Schistosoma mansoni	peroxidasin	0.0218	0.7058	1
Echinococcus multilocularis	g protein coupled receptor	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0052	0.1358	0.1924
Onchocerca volvulus		0.0218	0.7058	1
Echinococcus granulosus	g protein coupled receptor	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Onchocerca volvulus	Chorion peroxidase homolog	0.0218	0.7058	1
Schistosoma mansoni	myosin xvIII	0.0052	0.1358	0.1277
Brugia malayi	hypothetical protein	0.0052	0.1358	0.1843
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0052	0.1358	0.1903
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0052	0.1358	0.1903
Schistosoma mansoni	neuropeptide f receptor 76f	0.0052	0.1358	0.1277
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0052	0.1358	0.1903
Echinococcus granulosus	neuropeptide FF receptor 2	0.0052	0.1358	0.1903
Onchocerca volvulus		0.0052	0.1358	0.1277
Schistosoma mansoni	neuropeptide receptor	0.0052	0.1358	0.1277
Brugia malayi	Animal haem peroxidase family protein	0.0218	0.7058	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0052	0.1358	0.1277
Onchocerca volvulus		0.0052	0.1358	0.1277
Echinococcus granulosus	neuropeptides capa receptor	0.0052	0.1358	0.1903
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0052	0.1358	0.1277
Onchocerca volvulus		0.0052	0.1358	0.1277
Brugia malayi	G protein-coupled receptor	0.0052	0.1358	0.1843
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Brugia malayi	G-protein coupled receptor	0.0052	0.1358	0.1843
Brugia malayi	Muscleblind-like protein	0.0157	0.4955	0.699
Brugia malayi	hypothetical protein	0.0052	0.1358	0.1843
Schistosoma mansoni	amine GPCR	0.0052	0.1358	0.1277
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0052	0.1358	0.1903
Echinococcus multilocularis	fmrfamide receptor	0.0052	0.1358	0.1903
Echinococcus granulosus	7tm_1 domain containing protein	0.0052	0.1358	0.1903
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Echinococcus granulosus	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Echinococcus granulosus	g protein coupled receptor	0.0052	0.1358	0.1903
Echinococcus multilocularis	sex peptide receptor	0.0052	0.1358	0.1903
Schistosoma mansoni	amine GPCR	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Leishmania major	squalene synthase, putative	0.0295602	0.5	0.5
Loa Loa (eye worm)	TYRA-2 protein	0.0052	0.1358	0.1924
Onchocerca volvulus		0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0523	0.0741
Brugia malayi	neuropeptide F receptor	0.0052	0.1358	0.1843
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0052	0.1358	0.1277
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0052	0.1358	0.1903
Schistosoma mansoni	neuropeptide receptor	0.0052	0.1358	0.1277
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0094	0.2805	0.3974
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Echinococcus granulosus	Squalene phytoene synthase	0.0094	0.2805	0.3958
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0052	0.1358	0.1903
Echinococcus granulosus	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Schistosoma mansoni	opsin-like receptor	0.0052	0.1358	0.1277
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0052	0.1358	0.1277
Echinococcus granulosus	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Schistosoma mansoni	neuropeptide receptor	0.0052	0.1358	0.1277
Echinococcus granulosus	tm gpcr rhodopsin	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Echinococcus multilocularis	serotonin receptor	0.0052	0.1358	0.1903
Schistosoma mansoni	hypothetical protein	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Onchocerca volvulus		0.0052	0.1358	0.1277
Schistosoma mansoni	amine GPCR	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0052	0.1358	0.1277
Echinococcus granulosus	neuropeptide Y receptor	0.0052	0.1358	0.1903
Echinococcus granulosus	neuropeptide receptor A26	0.0052	0.1358	0.1903
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Schistosoma mansoni	growth hormone secretagogue receptor	0.0052	0.1358	0.1277
Brugia malayi	Dopamine receptor	0.0052	0.1358	0.1843
Echinococcus granulosus	serotonin receptor	0.0052	0.1358	0.1903
Schistosoma mansoni	hypothetical protein	0.0094	0.2805	0.3491
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0052	0.1358	0.1277
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0052	0.1358	0.1903
Echinococcus multilocularis	peroxidasin	0.0218	0.7058	1
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0052	0.1358	0.1903
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0052	0.1358	0.1277
Echinococcus multilocularis	neuropeptide s receptor	0.0052	0.1358	0.1903
Loa Loa (eye worm)	animal heme peroxidase	0.0218	0.7058	1
Echinococcus granulosus	sex peptide receptor	0.0052	0.1358	0.1903
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Onchocerca volvulus		0.0052	0.1358	0.1277
Mycobacterium tuberculosis	Probable phytoene synthase PhyA	0.0094	0.2805	0.5
Echinococcus granulosus	lamin dm0	0.0028	0.0523	0.0718
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0052	0.1358	0.1903
Echinococcus multilocularis	neuropeptides capa receptor	0.0052	0.1358	0.1903
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Loa Loa (eye worm)	neuropeptide F receptor	0.0052	0.1358	0.1924
Onchocerca volvulus		0.0052	0.1358	0.1277
Schistosoma mansoni	hypothetical protein	0.0052	0.1358	0.1277
Brugia malayi	Animal haem peroxidase family protein	0.0218	0.7058	1
Onchocerca volvulus		0.0052	0.1358	0.1277
Echinococcus multilocularis	muscleblind protein	0.0157	0.4955	0.7013
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0052	0.1358	0.1903
Echinococcus granulosus	allatostatin A receptor	0.0052	0.1358	0.1903
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0052	0.1358	0.1903
Schistosoma mansoni	neuropeptide F-like receptor	0.0052	0.1358	0.1277
Brugia malayi	hypothetical protein	0.0052	0.1358	0.1843
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0052	0.1358	0.1277
Trypanosoma cruzi	squalene synthase, putative	0.0303	1	1
Echinococcus multilocularis	lamin	0.0028	0.0523	0.0718
Brugia malayi	Animal haem peroxidase family protein	0.0218	0.7058	1
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Brugia malayi	hypothetical protein	0.0052	0.1358	0.1843
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0052	0.1358	0.1903
Echinococcus multilocularis	neuropeptides capa receptor	0.0052	0.1358	0.1903
Echinococcus granulosus	neuropeptide s receptor	0.0052	0.1358	0.1903
Echinococcus granulosus	neuropeptide Y receptor	0.0052	0.1358	0.1903
Echinococcus granulosus	neuropeptides capa receptor	0.0052	0.1358	0.1903
Brugia malayi	larval opioid receptor	0.0052	0.1358	0.1843
Echinococcus multilocularis	neuropeptide receptor A26	0.0052	0.1358	0.1903
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0052	0.1358	0.1277
Schistosoma mansoni	amine GPCR	0.0052	0.1358	0.1277
Onchocerca volvulus		0.0052	0.1358	0.1277
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0052	0.1358	0.1277
Schistosoma mansoni	neuropeptide F-like receptor	0.0052	0.1358	0.1277
Echinococcus granulosus	neuropeptide receptor	0.0052	0.1358	0.1903
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0052	0.1358	0.1843
Schistosoma mansoni	hypothetical protein	0.0052	0.1358	0.1277
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0052	0.1358	0.1843
Echinococcus multilocularis	neuropeptide receptor	0.0052	0.1358	0.1903
Brugia malayi	hypothetical protein	0.0052	0.1358	0.1843
Onchocerca volvulus	Peroxidase homolog	0.0218	0.7058	1
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0052	0.1358	0.1277
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Schistosoma mansoni	adenoreceptor	0.0052	0.1358	0.1277
Schistosoma mansoni	opsin-like receptor	0.0052	0.1358	0.1277
Brugia malayi	putative neuropeptide receptor	0.0052	0.1358	0.1843
Brugia malayi	GnHR receptor homolog	0.0052	0.1358	0.1843
Loa Loa (eye worm)	hypothetical protein	0.0218	0.7058	1
Trypanosoma cruzi	squalene synthase, putative	0.0295602	0.5	0.5
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1358	0.1924
Brugia malayi	Dopamine receptor protein 1	0.0052	0.1358	0.1843

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)		Inhibition of human recombinant squalene synthase expressed in Escherichia coli BL21(DE3 pLysS) up to 1 uM by liquid scintillation counter	ChEMBL.	17709461
IC50 (binding)	> 1 uM	Inhibition of Leishmania major recombinant squalene synthase expressed in Escherichia coli by liquid scintillation counter	ChEMBL.	17709461
IC50 (functional)	= 5.5 uM	Trypanocidal activity against Trypanosoma brucei rhodesiense STIB 900 bloodstream form after 72 hrs by resazurin assay	ChEMBL.	17709461
IC50 (functional)	= 12.3 uM	Antiplasmodial activity after 48 hrs against chloroquine and pyrimethamine-resistant Plasmodium falciparum K1 in human erythrocytes by [3H]hypoxanthine uptake	ChEMBL.	17709461
IC50 (functional)	= 46 uM	Antitrypanosomal activity against trypomastigotes of Trypanosoma cruzi Tulahuen C2C4 containing lacZ gene in rat L6 cells after 4 days by chlorophenol red-beta-D-galactopyranoside/Nonidet assay	ChEMBL.	17709461
IC50 (functional)	= 82.1 uM	Antileishmanial activity against Leishmania donovani MHOM/ET/67/L82 axenic amastigotes after 72 hrs by resazurin assay	ChEMBL.	17709461

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Trypanosoma brucei gambiense		17709461
Plasmodium falciparum		17709461

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: CHEMBL504277

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1000083