TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 451.403 | Formula: C21H23F6NO3
H donors: 2 H acceptors: 2 LogP: 4.31 Rotable bonds: 11
Rule of 5 violations (Lipinski): 1
SMILES: CCN(C(c1ccccc1)COCCO)c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)O
InChi: 1S/C21H23F6NO3/c1-2-28(18(14-31-13-12-29)15-6-4-3-5-7-15)17-10-8-16(9-11-17)19(30,20(22,23)24)21(25,26)27/h3-11,18,29-30H,2,12-14H2,1H3
InChiKey: JALYOEQAGVCURF-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

Species	Target name	Source	Bibliographic reference
Homo sapiens	nuclear receptor subfamily 1, group H, member 3	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Onchocerca volvulus	Bile acid receptor homolog	Get druggable targets OG5_134445	All targets in OG5_134445
Brugia malayi	ecdysteroid receptor	Get druggable targets OG5_134445	All targets in OG5_134445
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_134445	All targets in OG5_134445

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	photoreceptor-specific nuclear receptor	nuclear receptor subfamily 1, group H, member 3	387 aa	321 aa	28.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.014	0.2499	0.2499
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.014	0.2499	0.2499
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	sex peptide receptor	0.014	0.2499	0.2499
Brugia malayi	RE15519p	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus granulosus	fmrfamide receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Schistosoma mansoni	opsin-like receptor	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Echinococcus multilocularis	proto oncogene serine:threonine protein kinase	0.0523	1	1
Echinococcus multilocularis	neuropeptide receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus granulosus	proto oncogene serine:threonine protein kinase	0.0523	1	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.014	0.2499	0.2499
Echinococcus granulosus	tachykinin peptides receptor 99D	0.014	0.2499	0.2499
Echinococcus granulosus	sex peptide receptor	0.014	0.2499	0.2499
Schistosoma mansoni	growth hormone secretagogue receptor	0.014	0.2499	0.2499
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.014	0.2499	0.2499
Echinococcus granulosus	7TM GPCR rhodopsin	0.014	0.2499	0.2499
Schistosoma mansoni	neuropeptide F-like receptor	0.014	0.2499	0.2499
Echinococcus granulosus	G protein coupled receptor 139	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	serotonin receptor	0.014	0.2499	0.2499
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.014	0.2499	0.2499
Echinococcus granulosus	g protein coupled receptor	0.014	0.2499	0.2499
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.014	0.2499	0.2499
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.014	0.2499	0.2499
Echinococcus multilocularis	g-protein coupled receptor	0.014	0.2499	0.2499
Schistosoma mansoni	hypothetical protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Brugia malayi	hypothetical protein	0.014	0.2499	0.2499
Schistosoma mansoni	amine GPCR	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.014	0.2499	0.2499
Schistosoma mansoni	amine GPCR	0.014	0.2499	0.2499
Echinococcus granulosus	neuropeptide receptor A26	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	neuropeptide receptor A26	0.014	0.2499	0.2499
Schistosoma mansoni	neuropeptide receptor	0.014	0.2499	0.2499
Onchocerca volvulus	Bile acid receptor homolog	0.0197	0.3627	0.3627
Brugia malayi	GnHR receptor homolog	0.014	0.2499	0.2499
Brugia malayi	hypothetical protein	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Brugia malayi	putative neuropeptide receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Schistosoma mansoni	amine GPCR	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Echinococcus granulosus	neuropeptides capa receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.014	0.2499	0.2499
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus granulosus	somatostatin receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	G-protein coupled receptor	0.014	0.2499	0.2499
Echinococcus granulosus	biogenic amine 5HT receptor	0.014	0.2499	0.2499
Brugia malayi	follicle stimulating hormone receptor	0.014	0.2499	0.2499
Brugia malayi	G protein-coupled receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	neuropeptide Y receptor	0.014	0.2499	0.2499
Echinococcus granulosus	biogenic amine 5HT receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Brugia malayi	larval opioid receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Schistosoma mansoni	biogenic amine (5HT) receptor	0.014	0.2499	0.2499
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	neuropeptides capa receptor	0.014	0.2499	0.2499
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.014	0.2499	0.2499
Schistosoma mansoni	neuropeptide f receptor 76f	0.014	0.2499	0.2499
Schistosoma mansoni	amine GPCR	0.014	0.2499	0.2499
Echinococcus granulosus	g-protein coupled receptor	0.014	0.2499	0.2499
Schistosoma mansoni	biogenic amine (5HT) receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.0523	1	1
Echinococcus granulosus	neuropeptide FF receptor 2	0.014	0.2499	0.2499
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Brugia malayi	Dopamine receptor protein 2	0.014	0.2499	0.2499
Echinococcus granulosus	neuropeptide receptor	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Schistosoma mansoni	myosin xvIII	0.014	0.2499	0.2499
Echinococcus granulosus	tm gpcr rhodopsin	0.014	0.2499	0.2499
Brugia malayi	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.014	0.2499	0.2499
Schistosoma mansoni	opsin-like receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Schistosoma mansoni	neuropeptide receptor	0.014	0.2499	0.2499
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.014	0.2499	0.2499
Echinococcus granulosus	neuropeptide receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	allatostatin A receptor	0.014	0.2499	0.2499
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.014	0.2499	0.2499
Echinococcus multilocularis	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Echinococcus multilocularis	neuropeptide Y receptor	0.014	0.2499	0.2499
Brugia malayi	Melatonin receptor type 1A	0.014	0.2499	0.2499
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Brugia malayi	G-protein coupled receptor	0.014	0.2499	0.2499
Echinococcus granulosus	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Echinococcus granulosus	alpha 1A adrenergic receptor	0.014	0.2499	0.2499
Brugia malayi	ORL1-like opioid receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	neuropeptide F receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	neuropeptide FF receptor 2	0.014	0.2499	0.2499
Brugia malayi	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.014	0.2499	0.2499
Echinococcus granulosus	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Loa Loa (eye worm)	G-protein coupled receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	orexin receptor type 2	0.014	0.2499	0.2499
Schistosoma mansoni	neuropeptide receptor	0.014	0.2499	0.2499
Brugia malayi	hypothetical protein	0.014	0.2499	0.2499
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.014	0.2499	0.2499
Echinococcus granulosus	neuropeptides capa receptor	0.014	0.2499	0.2499
Schistosoma mansoni	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	g protein coupled receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.014	0.2499	0.2499
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.014	0.2499	0.2499
Brugia malayi	AKH receptor	0.014	0.2499	0.2499
Onchocerca volvulus	Neuropeptide F receptor homolog	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.014	0.2499	0.2499
Echinococcus granulosus	g protein coupled receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus granulosus	neuropeptide s receptor	0.014	0.2499	0.2499
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.014	0.2499	0.2499
Echinococcus granulosus	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.014	0.2499	0.2499
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.014	0.2499	0.2499
Echinococcus multilocularis	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Brugia malayi	hypothetical protein	0.014	0.2499	0.2499
Schistosoma mansoni	amine GPCR	0.014	0.2499	0.2499
Brugia malayi	G protein-coupled receptor F59B2.13	0.014	0.2499	0.2499
Echinococcus granulosus	neuropeptide Y receptor	0.014	0.2499	0.2499
Echinococcus granulosus	neuropeptide Y receptor	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	melatonin receptor type 1A	0.014	0.2499	0.2499
Echinococcus multilocularis	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Echinococcus multilocularis	g protein coupled receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	neuropeptides capa receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	fmrfamide receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.014	0.2499	0.2499
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.014	0.2499	0.2499
Schistosoma mansoni	histamine h1 receptor	0.014	0.2499	0.2499
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.014	0.2499	0.2499
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	neuropeptide receptor	0.014	0.2499	0.2499
Onchocerca volvulus	Serine\/threonine protein kinase homolog	0.0523	1	1
Brugia malayi	Tachykinin-like peptides receptor 99D	0.014	0.2499	0.2499
Schistosoma mansoni	hypothetical protein	0.014	0.2499	0.2499
Echinococcus granulosus	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Brugia malayi	G-protein coupled receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	G-protein coupled receptor, putative	0.014	0.2499	0.2499
Brugia malayi	putative neuropeptide receptor NPR1	0.014	0.2499	0.2499
Brugia malayi	neuropeptide F receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	g protein coupled receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Brugia malayi	Serotonin receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Schistosoma mansoni	alpha-1 adrenergic receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Brugia malayi	sulfakinin receptor protein	0.014	0.2499	0.2499
Brugia malayi	Serotonin receptor	0.014	0.2499	0.2499
Echinococcus granulosus	orexin receptor type 2	0.014	0.2499	0.2499
Echinococcus granulosus	g protein coupled receptor	0.014	0.2499	0.2499
Echinococcus granulosus	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus granulosus	dro:myosuppressin receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	neuropeptide F receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	dro:myosuppressin receptor	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Brugia malayi	Serine/threonine-protein kinase Pim-3	0.0523	1	1
Brugia malayi	hypothetical protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	TYRA-2 protein	0.014	0.2499	0.2499
Echinococcus granulosus	tm gpcr rhodopsin	0.014	0.2499	0.2499
Schistosoma mansoni	neuropeptide receptor	0.014	0.2499	0.2499
Schistosoma mansoni	neuropeptide F-like receptor	0.014	0.2499	0.2499
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.014	0.2499	0.2499
Echinococcus granulosus	tm gpcr rhodopsin	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.014	0.2499	0.2499
Brugia malayi	neuropeptide F receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	neuropeptide s receptor	0.014	0.2499	0.2499
Schistosoma mansoni	serine/threonine protein kinase	0.0523	1	1
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Brugia malayi	hypothetical protein	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Schistosoma mansoni	opsin-like receptor	0.014	0.2499	0.2499
Brugia malayi	ecdysteroid receptor	0.0197	0.3627	0.3627
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	G protein coupled receptor 139	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	somatostatin receptor	0.014	0.2499	0.2499
Brugia malayi	hypothetical protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.0523	1	1
Echinococcus granulosus	peptide allatostatin:somatostatin	0.014	0.2499	0.2499
Brugia malayi	hypothetical protein	0.014	0.2499	0.2499
Echinococcus multilocularis	serotonin receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.014	0.2499	0.2499
Echinococcus granulosus	allatostatin A receptor	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Schistosoma mansoni	biogenic amine receptor	0.014	0.2499	0.2499
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.014	0.2499	0.2499
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.014	0.2499	0.2499
Schistosoma mansoni	hypothetical protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.014	0.2499	0.2499
Onchocerca volvulus		0.014	0.2499	0.2499
Schistosoma mansoni	biogenic amine receptor	0.014	0.2499	0.2499
Schistosoma mansoni	adenoreceptor	0.014	0.2499	0.2499
Echinococcus granulosus	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.014	0.2499	0.2499
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	fmrfamide receptor	0.014	0.2499	0.2499
Schistosoma mansoni	biogenic amine receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.014	0.2499	0.2499
Brugia malayi	Dopamine receptor	0.014	0.2499	0.2499
Echinococcus granulosus	hypothetical protein	0.014	0.2499	0.2499
Echinococcus granulosus	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Echinococcus granulosus	7tm_1 domain containing protein	0.014	0.2499	0.2499
Loa Loa (eye worm)	hypothetical protein	0.0197	0.3627	0.3627
Loa Loa (eye worm)	hypothetical protein	0.014	0.2499	0.2499
Echinococcus granulosus	serotonin receptor	0.014	0.2499	0.2499
Echinococcus multilocularis	rhodopsin orphan GPCR	0.014	0.2499	0.2499
Brugia malayi	Dopamine receptor protein 1	0.014	0.2499	0.2499

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	0	Transactivation of LXRbeta relative to T0901317 by luciferase reporter gene assay	ChEMBL.	16876993
Activity (functional)	0	Transactivation of LXRalpha relative to T0901317 by luciferase reporter gene assay	ChEMBL.	16876993
EC50 (functional)	> 40 uM	Transactivation of LXRalpha by luciferase reporter gene assay	ChEMBL.	16876993
EC50 (functional)	> 40 uM	Transactivation of LXRbeta by luciferase reporter gene assay	ChEMBL.	16876993
EC50 (functional)	> 40 uM	Transactivation of LXRalpha by luciferase reporter gene assay	ChEMBL.	16876993
EC50 (functional)	> 40 uM	Transactivation of LXRbeta by luciferase reporter gene assay	ChEMBL.	16876993
IC50 (binding)	= 12 uM	Binding affinity to LXRalpha by radioligand displacement assay	ChEMBL.	16876993
IC50 (binding)	= 12 uM	Binding affinity to LXRalpha by radioligand displacement assay	ChEMBL.	16876993
IC50 (binding)	= 32 uM	Binding affinity to LXRbeta by radioligand displacement assay	ChEMBL.	16876993
IC50 (binding)	= 32 uM	Binding affinity to LXRbeta by radioligand displacement assay	ChEMBL.	16876993

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: CHEMBL214915

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 371930