TDR Targets

Basic information

Technical information

TDR Targets ID: 441333
Name: 2-[3-(2,6-dimethoxyphenyl)phenyl]-N,N-dimethy lethanamine
MW: 285.381 | Formula: C18H23NO2
H donors: 0 H acceptors: 0 LogP: 3.79 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: COc1cccc(c1c1cccc(c1)CCN(C)C)OC
InChi: 1S/C18H23NO2/c1-19(2)12-11-14-7-5-8-15(13-14)18-16(20-3)9-6-10-17(18)21-4/h5-10,13H,11-12H2,1-4H3
InChiKey: KEZANYAKTRIHDI-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

2-[3-(2,6-dimethoxyphenyl)phenyl]-N,N-dimethyl-ethanamine
2-[3-(2,6-dimethoxyphenyl)phenyl]ethyl-dimethyl-amine

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Rattus norvegicus	Serotonin 1a (5-HT1a) receptor	Starlite/ChEMBL	References
Homo sapiens	5-hydroxytryptamine (serotonin) receptor 7, adenylate cyclase-coupled	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus granulosus	biogenic amine 5HT receptor	Get druggable targets OG5_133249	All targets in OG5_133249
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_133249	All targets in OG5_133249
Schistosoma japonicum	expressed protein	Get druggable targets OG5_133249	All targets in OG5_133249
Schistosoma mansoni	biogenic amine (5HT) receptor	Get druggable targets OG5_133249	All targets in OG5_133249
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_133249	All targets in OG5_133249
Echinococcus multilocularis	serotonin receptor	Get druggable targets OG5_133249	All targets in OG5_133249
Echinococcus granulosus	biogenic amine 5HT receptor	Get druggable targets OG5_133074	All targets in OG5_133074
Echinococcus multilocularis	serotonin receptor	Get druggable targets OG5_133249	All targets in OG5_133249
Schistosoma japonicum	Octopamine receptor, putative	Get druggable targets OG5_133249	All targets in OG5_133249
Echinococcus multilocularis	biogenic amine (5HT) receptor	Get druggable targets OG5_133074	All targets in OG5_133074
Schistosoma mansoni	biogenic amine (5HT) receptor	Get druggable targets OG5_133074	All targets in OG5_133074
Schistosoma japonicum	ko:K04153 5-hydroxytryptamine (serotonin) receptor 1A, putative	Get druggable targets OG5_133249	All targets in OG5_133249

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Echinococcus multilocularis	orexin receptor type 2	Serotonin 1a (5-HT1a) receptor	422 aa	369 aa	22.2 %
Echinococcus multilocularis	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	433 aa	22.4 %
Loa Loa (eye worm)	hypothetical protein	Serotonin 1a (5-HT1a) receptor	422 aa	388 aa	26.5 %
Echinococcus granulosus	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	432 aa	24.3 %
Echinococcus granulosus	orexin receptor type 2	Serotonin 1a (5-HT1a) receptor	422 aa	369 aa	22.0 %
Schistosoma japonicum	ko:K04207 neuropeptide Y receptor Y5, putative	Serotonin 1a (5-HT1a) receptor	422 aa	339 aa	23.0 %
Schistosoma japonicum	ko:K04145 dopamine receptor D2, putative	Serotonin 1a (5-HT1a) receptor	422 aa	410 aa	27.8 %
Echinococcus granulosus	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	432 aa	23.4 %
Onchocerca volvulus	Glycoprotein hormone beta 5 homolog	Serotonin 1a (5-HT1a) receptor	422 aa	477 aa	24.3 %
Schistosoma mansoni	amine GPCR	Serotonin 1a (5-HT1a) receptor	422 aa	440 aa	31.6 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	436 aa	23.9 %
Echinococcus multilocularis	g protein coupled receptor	Serotonin 1a (5-HT1a) receptor	422 aa	432 aa	23.6 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	426 aa	29.6 %
Schistosoma japonicum	IPR000276,Rhodopsin-like GPCR superfamily,domain-containing	Serotonin 1a (5-HT1a) receptor	422 aa	417 aa	21.1 %
Schistosoma japonicum	IPR000276,Rhodopsin-like GPCR superfamily,domain-containing	Serotonin 1a (5-HT1a) receptor	422 aa	392 aa	20.7 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	407 aa	23.3 %
Schistosoma japonicum	Octopamine receptor 1, putative	Serotonin 1a (5-HT1a) receptor	422 aa	424 aa	24.3 %
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	Serotonin 1a (5-HT1a) receptor	422 aa	350 aa	20.6 %
Schistosoma japonicum	ko:K04135 adrenergic receptor, alpha 1a, putative	Serotonin 1a (5-HT1a) receptor	422 aa	448 aa	29.7 %
Onchocerca volvulus		Serotonin 1a (5-HT1a) receptor	422 aa	390 aa	33.6 %
Echinococcus multilocularis	neuropeptides capa receptor	Serotonin 1a (5-HT1a) receptor	422 aa	430 aa	20.0 %
Echinococcus granulosus	alpha 1A adrenergic receptor	Serotonin 1a (5-HT1a) receptor	422 aa	452 aa	21.0 %
Schistosoma japonicum	ko:K04136 adrenergic receptor, alpha 1b, putative	Serotonin 1a (5-HT1a) receptor	422 aa	444 aa	29.3 %
Onchocerca volvulus	Mitochondrial inner membrane protein homolog	Serotonin 1a (5-HT1a) receptor	422 aa	383 aa	30.5 %
Loa Loa (eye worm)	TYRA-2 protein	Serotonin 1a (5-HT1a) receptor	422 aa	491 aa	27.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.006	0.0058
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	biogenic amine 5HT receptor	0.046	0.5176	0.5175
Schistosoma mansoni	neuropeptide receptor	0.0006	0.0026	0.0025
Onchocerca volvulus		0.0006	0.0026	0.0883
Schistosoma mansoni	hypothetical protein	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0004	0.0007	0.0005
Onchocerca volvulus		0.0006	0.0026	0.0883
Loa Loa (eye worm)	MH2 domain-containing protein	0.0008	0.0052	0.0296
Schistosoma mansoni	opsin-like receptor	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus granulosus	neuropeptide Y receptor	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Loa Loa (eye worm)	neuropeptide F receptor	0.0006	0.0026	0.0146
Echinococcus granulosus	p2X purinoceptor 4	0.0886	1	1
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0006	0.0026	0.0025
Brugia malayi	neuropeptide F receptor	0.0006	0.0026	0.0191
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0006	0.0026	0.0025
Echinococcus multilocularis	somatostatin receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	smad	0.0008	0.0052	0.005
Echinococcus granulosus	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Echinococcus multilocularis	g-protein coupled receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0006	0.0026	0.0025
Onchocerca volvulus		0.0006	0.0026	0.0883
Schistosoma mansoni	neuropeptide F-like receptor	0.0006	0.0026	0.0025
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0034	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Brugia malayi	G protein-coupled receptor	0.0006	0.0026	0.0191
Echinococcus granulosus	orexin receptor type 2	0.0006	0.0026	0.0025
Echinococcus granulosus	neuropeptide s receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	mothers against decapentaplegic 5	0.0008	0.0052	0.005
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Brugia malayi	MH2 domain containing protein	0.0008	0.0052	0.0389
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0053	0.0566	0.5
Echinococcus granulosus	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0008	0.0052	0.005
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Onchocerca volvulus		0.0006	0.0026	0.0883
Brugia malayi	AKH receptor	0.0006	0.0026	0.0191
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0006	0.0026	0.0025
Brugia malayi	Smad1	0.0008	0.0052	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Schistosoma mansoni	neuropeptide F-like receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	hypothetical protein	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Schistosoma mansoni	biogenic amine receptor	0.0006	0.0026	0.0025
Brugia malayi	Serotonin receptor	0.0006	0.0026	0.0191
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus multilocularis	sex peptide receptor	0.0006	0.0026	0.0025
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus multilocularis	cpg binding protein	0.003	0.0299	0.0297
Echinococcus multilocularis	Smad4	0.0008	0.0052	0.005
Echinococcus multilocularis	neuropeptide receptor	0.0006	0.0026	0.0025
Echinococcus multilocularis	smad	0.0008	0.0052	0.005
Brugia malayi	Dopamine receptor protein 2	0.0006	0.0026	0.0191
Brugia malayi	neuropeptide F receptor	0.0006	0.0026	0.0191
Echinococcus granulosus	cpg binding protein	0.003	0.0299	0.0297
Echinococcus multilocularis	serotonin receptor	0.0153	0.1692	0.1691
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Onchocerca volvulus		0.0006	0.0026	0.0883
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0006	0.0026	0.0025
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0006	0.0026	0.0146
Onchocerca volvulus		0.0006	0.0026	0.0883
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0034	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0006	0.0026	0.0146
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0006	0.0026	0.0025
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Brugia malayi	larval opioid receptor	0.0006	0.0026	0.0191
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0006	0.0026	0.0025
Brugia malayi	Serotonin receptor	0.0006	0.0026	0.0191
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0796	0.8976	0.8975
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0153	0.1692	1
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Schistosoma mansoni	hypothetical protein	0.0006	0.0026	0.0025
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0034	1
Schistosoma mansoni	opsin-like receptor	0.0006	0.0026	0.0025
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0006	0.0026	0.0025
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0007	0.004	0.0039
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0006	0.0026	0.0146
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0006	0.0026	0.0191
Loa Loa (eye worm)	nuclear factor I	0.0004	0.0011	0.0057
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus multilocularis	neuropeptide receptor A26	0.0006	0.0026	0.0025
Echinococcus multilocularis	neuropeptide Y receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	neuropeptides capa receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	neuropeptide receptor	0.0006	0.0026	0.0025
Echinococcus multilocularis	allatostatin A receptor	0.0006	0.0026	0.0025
Brugia malayi	putative neuropeptide receptor NPR1	0.0006	0.0026	0.0191
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Loa Loa (eye worm)	G-protein coupled receptor	0.0006	0.0026	0.0146
Brugia malayi	CXXC zinc finger family protein	0.0028	0.028	0.2167
Brugia malayi	Dopamine receptor	0.0006	0.0026	0.0191
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0006	0.0026	0.0025
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0034	1
Schistosoma mansoni	P2X receptor subunit	0.0886	1	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0006	0.0026	0.0025
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0006	0.0026	0.0883
Echinococcus multilocularis	neuropeptide s receptor	0.0006	0.0026	0.0025
Brugia malayi	hypothetical protein	0.0006	0.0026	0.0191
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Brugia malayi	hypothetical protein	0.0006	0.0026	0.0191
Echinococcus granulosus	g protein coupled receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	serotonin receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	dro:myosuppressin receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	smad	0.0008	0.0052	0.005
Loa Loa (eye worm)	melatonin receptor type 1A	0.0006	0.0026	0.0146
Echinococcus multilocularis	serotonin receptor	0.0153	0.1692	0.1691
Echinococcus multilocularis	p2X purinoceptor 4	0.0886	1	1
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0006	0.0026	0.0025
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0006	0.0026	0.0025
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0007	0.004	0.0039
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0052	0.005
Schistosoma mansoni	hypothetical protein	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Echinococcus multilocularis	neuropeptides capa receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	P2X receptor subunit	0.0886	1	1
Echinococcus multilocularis	orexin receptor type 2	0.0006	0.0026	0.0025
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus multilocularis	p2X purinoceptor 4	0.0886	1	1
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus granulosus	allatostatin A receptor	0.0006	0.0026	0.0025
Loa Loa (eye worm)	MH2 domain-containing protein	0.0117	0.1288	0.761
Echinococcus multilocularis	g protein coupled receptor	0.0006	0.0026	0.0025
Onchocerca volvulus		0.0006	0.0026	0.0883
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0006	0.0026	0.0025
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0006	0.0026	0.0883
Schistosoma mansoni	neuropeptide receptor	0.0006	0.0026	0.0025
Brugia malayi	G protein-coupled receptor F59B2.13	0.0006	0.0026	0.0191
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus multilocularis	g protein coupled receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0006	0.0026	0.0025
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0006	0.0026	0.0025
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0006	0.0026	0.0025
Schistosoma mansoni	biogenic amine (5HT) receptor	0.046	0.5176	0.5175
Schistosoma mansoni	amine GPCR	0.0006	0.0026	0.0025
Schistosoma mansoni	cpg binding protein	0.003	0.0299	0.0297
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0034	1
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0006	0.0026	0.0025
Brugia malayi	MH1 domain containing protein	0.0008	0.0052	0.0389
Brugia malayi	follicle stimulating hormone receptor	0.0006	0.0026	0.0191
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0006	0.0034	1
Schistosoma mansoni	Smad4	0.0008	0.0052	0.005
Brugia malayi	hypothetical protein	0.0006	0.0026	0.0191
Schistosoma mansoni	amine GPCR	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Onchocerca volvulus		0.0006	0.0026	0.0883
Schistosoma mansoni	amine GPCR	0.0006	0.0026	0.0025
Echinococcus granulosus	7tm_1 domain containing protein	0.0006	0.0026	0.0025
Echinococcus multilocularis	p2X purinoceptor 4	0.0886	1	1
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0006	0.0026	0.0025
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.006	0.0638	0.0637
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0006	0.0026	0.0146
Echinococcus multilocularis	G protein coupled receptor 139	0.0006	0.0026	0.0025
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.028	0.1649
Onchocerca volvulus		0.0006	0.0026	0.0883
Echinococcus granulosus	g protein coupled receptor	0.0006	0.0026	0.0025
Loa Loa (eye worm)	G-protein coupled receptor	0.0006	0.0026	0.0146
Brugia malayi	MH1 domain containing protein	0.0008	0.0052	0.0389
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	neuropeptide FF receptor 2	0.0006	0.0026	0.0025
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0153	0.1692	0.1691
Onchocerca volvulus		0.0006	0.0026	0.0883
Brugia malayi	sulfakinin receptor protein	0.0006	0.0026	0.0191
Schistosoma mansoni	cpg binding protein	0.003	0.0299	0.0297
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	tm gpcr rhodopsin	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0034	1
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0034	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0034	1
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus granulosus	hypothetical protein	0.0006	0.0026	0.0025
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0007	0.004	0.0039
Echinococcus multilocularis	g protein coupled receptor	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0008	0.0052	0.005
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0006	0.0034	1
Onchocerca volvulus		0.0006	0.0026	0.0883
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Schistosoma mansoni	amine GPCR	0.0006	0.0026	0.0025
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0006	0.0026	0.0025
Loa Loa (eye worm)	Smad1	0.0008	0.0052	0.0296
Schistosoma mansoni	amine GPCR	0.0006	0.0026	0.0025
Echinococcus granulosus	p2X purinoceptor 4	0.0886	1	1
Onchocerca volvulus		0.0006	0.0026	0.0883
Schistosoma mansoni	biogenic amine receptor	0.0006	0.0026	0.0025
Brugia malayi	hypothetical protein	0.0006	0.0026	0.0191
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0006	0.0026	0.0025
Brugia malayi	hypothetical protein	0.0006	0.0026	0.0191
Brugia malayi	hypothetical protein	0.0006	0.0026	0.0191
Trichomonas vaginalis	helicase, putative	0.0006	0.0034	1
Echinococcus granulosus	neuropeptide receptor	0.0006	0.0026	0.0025
Echinococcus multilocularis	fmrfamide receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	neuropeptide receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	cpg binding protein	0.0028	0.028	0.0279
Echinococcus granulosus	neuropeptide receptor	0.0006	0.0026	0.0025
Brugia malayi	hypothetical protein	0.0006	0.0026	0.0191
Schistosoma mansoni	P2X receptor subunit	0.0886	1	1
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Brugia malayi	G-protein coupled receptor	0.0006	0.0026	0.0191
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0052	0.005
Echinococcus granulosus	tm gpcr rhodopsin	0.0006	0.0026	0.0025
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0006	0.0026	0.0025
Brugia malayi	GnHR receptor homolog	0.0006	0.0026	0.0191
Schistosoma mansoni	histamine h1 receptor	0.0006	0.0026	0.0025
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0034	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Echinococcus granulosus	tm gpcr rhodopsin	0.0006	0.0026	0.0025
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0034	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.006	0.0058
Loa Loa (eye worm)	hypothetical protein	0.0153	0.1692	1
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Brugia malayi	F/Y-rich N-terminus family protein	0.0009	0.0059	0.0444
Loa Loa (eye worm)	TYRA-2 protein	0.0006	0.0026	0.0146
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0008	0.0052	0.005
Echinococcus granulosus	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0006	0.0026	0.0191
Echinococcus granulosus	7TM GPCR rhodopsin	0.0006	0.0026	0.0025
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0006	0.0026	0.0025
Onchocerca volvulus		0.0006	0.0026	0.0883
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0034	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.0153	0.1692	0.1691
Echinococcus multilocularis	dro:myosuppressin receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0006	0.0026	0.0025
Echinococcus granulosus	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0034	1
Echinococcus granulosus	somatostatin receptor	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus granulosus	neuropeptides capa receptor	0.0006	0.0026	0.0025
Onchocerca volvulus		0.0006	0.0026	0.0883
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0034	1
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0006	0.0026	0.0025
Loa Loa (eye worm)	histone methyltransferase	0.0009	0.006	0.0345
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0007	0.004	0.0039
Echinococcus multilocularis	neuropeptide receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0006	0.0026	0.0191
Echinococcus granulosus	fmrfamide receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0006	0.0026	0.0025
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0006	0.0026	0.0191
Brugia malayi	hypothetical protein	0.0006	0.0026	0.0191
Brugia malayi	hypothetical protein	0.0006	0.0026	0.0191
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.046	0.5176	0.5175
Brugia malayi	MH2 domain containing protein	0.0008	0.0052	0.0389
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0006	0.0026	0.0025
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0006	0.0026	0.0191
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0006	0.0026	0.0025
Schistosoma mansoni	smad1 5 8 and	0.0008	0.0052	0.005
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.0034	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0006	0.0034	1
Brugia malayi	hypothetical protein	0.0006	0.0026	0.0191
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Echinococcus granulosus	sex peptide receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	growth hormone secretagogue receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	neuropeptide f receptor 76f	0.0006	0.0026	0.0025
Brugia malayi	Melatonin receptor type 1A	0.0006	0.0026	0.0191
Onchocerca volvulus		0.0006	0.0026	0.0883
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0004	0.0011	0.0057
Loa Loa (eye worm)	transcription factor SMAD2	0.0117	0.1288	0.761
Schistosoma mansoni	opsin-like receptor	0.0006	0.0026	0.0025
Brugia malayi	G-protein coupled receptor	0.0006	0.0026	0.0191
Echinococcus multilocularis	neuropeptide Y receptor	0.0006	0.0026	0.0025
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0006	0.0026	0.0191
Echinococcus granulosus	neuropeptide Y receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	P2X receptor subunit	0.0886	1	1
Brugia malayi	RE15519p	0.0006	0.0026	0.0191
Onchocerca volvulus		0.0006	0.0026	0.0883
Brugia malayi	MH1 domain containing protein	0.0004	0.0011	0.0075
Echinococcus granulosus	g-protein coupled receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0008	0.0052	0.005
Schistosoma mansoni	adenoreceptor	0.0006	0.0026	0.0025
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0007	0.004	0.0039
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0006	0.0026	0.0025
Brugia malayi	Dopamine receptor protein 1	0.0006	0.0026	0.0191
Onchocerca volvulus		0.0006	0.0026	0.0883
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0006	0.0026	0.0146
Echinococcus granulosus	neuropeptide receptor A26	0.0006	0.0026	0.0025
Brugia malayi	MH2 domain containing protein	0.0117	0.1288	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0006	0.0026	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Echinococcus multilocularis	neuropeptides capa receptor	0.0006	0.0026	0.0025
Brugia malayi	ORL1-like opioid receptor	0.0006	0.0026	0.0191
Loa Loa (eye worm)	hypothetical protein	0.0006	0.0026	0.0146
Brugia malayi	putative neuropeptide receptor	0.0006	0.0026	0.0191
Schistosoma mansoni	biogenic amine receptor	0.0006	0.0026	0.0025
Loa Loa (eye worm)	MH1 domain-containing protein	0.0008	0.0052	0.0296
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0006	0.0026	0.0025
Echinococcus granulosus	g protein coupled receptor	0.0006	0.0026	0.0025
Echinococcus multilocularis	fmrfamide receptor	0.0006	0.0026	0.0025
Echinococcus granulosus	Smad4	0.0008	0.0052	0.005
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0006	0.0026	0.0025
Schistosoma mansoni	myosin xvIII	0.0006	0.0026	0.0025
Loa Loa (eye worm)	neuropeptide F receptor	0.0006	0.0026	0.0146
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0006	0.0026	0.0025
Brugia malayi	MH1 domain containing protein	0.0004	0.0011	0.0075
Onchocerca volvulus		0.0028	0.028	1
Echinococcus granulosus	G protein coupled receptor 139	0.0006	0.0026	0.0025

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)		Antagonist activity at 5HT7 receptor stimulated aldosterone secretion from rat adrenal cortex	ChEMBL.	17419056
Activity (functional)	0	Antagonist activity at 5HT7 receptor stimulated aldosterone secretion from rat adrenal cortex	ChEMBL.	17419056
Inhibition (binding)	= 3 %	Binding affinity to rat 5HT1A at 0.01 uM	ChEMBL.	17419056
Inhibition (binding)	= 3 %	Binding affinity to rat 5HT1A at 0.01 uM	ChEMBL.	17419056
Inhibition (binding)	= 18 %	Binding affinity to rat 5HT1A at 1 uM	ChEMBL.	17419056
Inhibition (binding)	= 18 %	Binding affinity to rat 5HT1A at 1 uM	ChEMBL.	17419056
Inhibition (binding)	= 50 %	Displacement of [3H]LSD from human 5HT7 in sf9 cells at 0.01 uM	ChEMBL.	17419056
Inhibition (binding)	= 50 %	Displacement of [3H]LSD from human 5HT7 in sf9 cells at 0.01 uM	ChEMBL.	17419056
Inhibition (binding)	= 100 %	Displacement of [3H]LSD from human 5HT7 in sf9 cells at 1 uM	ChEMBL.	17419056
Inhibition (binding)	= 100 %	Displacement of [3H]LSD from human 5HT7 in sf9 cells at 1 uM	ChEMBL.	17419056
Ki (binding)	= 8.6 nM	Displacement of [3H]LSD from human 5HT7 in sf9 cells	ChEMBL.	17419056
Ki (binding)	= 8.6 nM	Displacement of [3H]LSD from human 5HT7 in sf9 cells	ChEMBL.	17419056
Ki (binding)	= 4826 nM	Binding affinity to rat 5HT1A	ChEMBL.	17419056
Ki (binding)	= 4826 nM	Binding affinity to rat 5HT1A	ChEMBL.	17419056
Ratio Ki (binding)	= 60	Selectivity ratio of rat 5HT1A to human 5HT7	ChEMBL.	17419056

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: CHEMBL232791
PubChem: 24963860

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 441333