TDR Targets

Basic information

Technical information

TDR Targets ID: 255343
Name: 6-[[4-(3,4-dimethylphenyl)piperidin-1-yl]meth yl]-4H-1,4-benzoxazin-3-one
MW: 350.454 | Formula: C22H26N2O2
H donors: 1 H acceptors: 1 LogP: 3.68 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: O=C1COc2c(N1)cc(cc2)CN1CCC(CC1)c1ccc(c(c1)C)C
InChi: 1S/C22H26N2O2/c1-15-3-5-19(11-16(15)2)18-7-9-24(10-8-18)13-17-4-6-21-20(12-17)23-22(25)14-26-21/h3-6,11-12,18H,7-10,13-14H2,1-2H3,(H,23,25)
InChiKey: UROZVASCLWFZOW-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

6-[[4-(3,4-dimethylphenyl)-1-piperidyl]methyl]-4H-1,4-benzoxazin-3-one
6-[[4-(3,4-dimethylphenyl)-1-piperidinyl]methyl]-4H-1,4-benzoxazin-3-one
6-[[4-(3,4-dimethylphenyl)piperidino]methyl]-4H-1,4-benzoxazin-3-one

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	dopamine receptor D4	Starlite/ChEMBL	References
Homo sapiens	dopamine receptor D2	Starlite/ChEMBL	References
Homo sapiens	dopamine receptor D3	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	hypothetical protein	dopamine receptor D3	400 aa	392 aa	19.9 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	G protein coupled 5 hydroxytryptamine receptor	0.0126	0.3107	1
Brugia malayi	hypothetical protein	0.0126	0.3107	0.3098
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0126	0.3107	1
Schistosoma mansoni	ancient conserved domain protein 2 (cyclin m2)	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	melatonin receptor type 1A	0.0126	0.3107	0.3098
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Schistosoma mansoni	opsin-like receptor	0.0126	0.3107	1
Onchocerca volvulus		0.0126	0.3107	0.6781
Schistosoma mansoni	thyrotropin-releasing hormone receptor	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus granulosus	thyrotropin releasing hormone receptor	0.0126	0.3107	1
Echinococcus multilocularis	pyroglutamylated rfamide peptide receptor	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	ribonucleoside diphosphate reductase large	0.0084	0.1802	0.3826
Trichomonas vaginalis	replication factor A 1, rfa1, putative	0.0068	0.1313	0.6919
Echinococcus multilocularis	neuropeptide FF receptor 2	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	segment polarity protein dishevelled	0.0095	0.2136	0.5407
Echinococcus multilocularis	growth hormone secretagogue receptor type 1	0.0126	0.3107	1
Echinococcus granulosus	g protein coupled receptor	0.0126	0.3107	1
Onchocerca volvulus		0.0126	0.3107	0.6781
Schistosoma mansoni	opsin-like receptor	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0126	0.3107	1
Brugia malayi	replication factor A 73 kDa subunit	0.0068	0.1313	0.1155
Brugia malayi	Serotonin receptor	0.0126	0.3107	0.3098
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0126	0.3107	1
Echinococcus granulosus	adenylate cyclase type IX	0.0081	0.1718	0.3431
Onchocerca volvulus		0.0126	0.3107	0.6781
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0126	0.3107	1
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0126	0.3107	1
Echinococcus granulosus	allatostatin A receptor	0.0126	0.3107	1
Brugia malayi	G protein-coupled receptor F59B2.13	0.0126	0.3107	0.3098
Brugia malayi	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus granulosus	peptide allatostatin:somatostatin	0.0126	0.3107	1
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0126	0.3107	1
Brugia malayi	Domain found in Dishevelled, Egl-10, and Pleckstrin family protein	0.0095	0.2136	0.2046
Schistosoma mansoni	growth hormone secretagogue receptor	0.0126	0.3107	1
Echinococcus granulosus	neuropeptide Y receptor	0.0126	0.3107	1
Onchocerca volvulus		0.0058	0.0993	0.0347
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0126	0.3107	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0126	0.3107	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0126	0.3107	1
Brugia malayi	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus granulosus	neuropeptide s receptor	0.0126	0.3107	1
Echinococcus granulosus	neuropeptide Y receptor	0.0126	0.3107	1
Echinococcus granulosus	tachykinin peptides receptor 99D	0.0126	0.3107	1
Schistosoma mansoni	hypothetical protein	0.0126	0.3107	1
Echinococcus granulosus	fmrfamide receptor	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	0.0126	0.3107	1
Brugia malayi	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus granulosus	biogenic amine 5HT receptor	0.0126	0.3107	1
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0126	0.3107	1
Loa Loa (eye worm)	unidentified vitellogenin-linked transcript protein 6	0.0126	0.3107	0.3098
Echinococcus multilocularis	thyrotropin releasing hormone receptor	0.0126	0.3107	1
Echinococcus multilocularis	g protein coupled receptor	0.0126	0.3107	1
Loa Loa (eye worm)	replication factor A 73 kDa subunit	0.0068	0.1313	0.1155
Echinococcus multilocularis	adenylate cyclase type IX	0.0081	0.1718	0.3431
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	peptide (allatostatin:somatostatin)	0.0126	0.3107	1
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0126	0.3107	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0126	0.3107	1
Schistosoma mansoni	alpha-1 adrenergic receptor	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	fmrfamide receptor	0.0126	0.3107	1
Brugia malayi	hypothetical protein	0.0126	0.3107	0.3098
Schistosoma mansoni	neuropeptide F-like receptor	0.0126	0.3107	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0126	0.3107	1
Echinococcus granulosus	tm gpcr rhodopsin	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	alpha 1A adrenergic receptor	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Brugia malayi	hypothetical protein	0.0126	0.3107	0.3098
Brugia malayi	sulfakinin receptor protein	0.0332	0.9479	1
Brugia malayi	Serotonin receptor	0.0126	0.3107	0.3098
Echinococcus multilocularis	G-protein coupled receptor, putative	0.0126	0.3107	1
Onchocerca volvulus		0.0126	0.3107	0.6781
Schistosoma mansoni	neuropeptide f receptor 76f	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Brugia malayi	GnHR receptor homolog	0.0126	0.3107	0.3098
Echinococcus granulosus	neuropeptide FF receptor 2	0.0126	0.3107	1
Echinococcus granulosus	7TM GPCR rhodopsin	0.0126	0.3107	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0126	0.3107	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0126	0.3107	1
Trypanosoma brucei	ribonucleoside-diphosphate reductase large chain	0.0084	0.1802	1
Echinococcus multilocularis	G protein coupled receptor 139	0.0126	0.3107	1
Schistosoma mansoni	ribonucleoside-diphosphate reductase alpha subunit	0.0084	0.1802	0.5437
Schistosoma mansoni	dishevelled	0.0095	0.2136	0.6605
Schistosoma mansoni	muscarinic acetylcholine (GAR) receptor	0.0126	0.3107	1
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0126	0.3107	1
Schistosoma mansoni	neuropeptide receptor	0.0126	0.3107	1
Echinococcus granulosus	G protein coupled receptor 139	0.0126	0.3107	1
Onchocerca volvulus		0.0126	0.3107	0.6781
Loa Loa (eye worm)	ribonucleoside-diphosphate reductase large subunit	0.0084	0.1802	0.1684
Schistosoma mansoni	amine GPCR	0.0126	0.3107	1
Brugia malayi	G-protein coupled receptor	0.0126	0.3107	0.3098
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Onchocerca volvulus		0.0126	0.3107	0.6781
Brugia malayi	G protein-coupled receptor	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Brugia malayi	Serotonin/octopamine receptor family protein 7	0.0126	0.3107	0.3098
Echinococcus granulosus	somatostatin receptor	0.0126	0.3107	1
Schistosoma mansoni	peptide (allatostatin/somatostatin)-like receptor	0.0126	0.3107	1
Plasmodium vivax	ribonucleoside-diphosphate reductase large chain, putative	0.0084	0.1802	1
Onchocerca volvulus	Adenylate cyclase type 3 homolog	0.016	0.4165	1
Onchocerca volvulus		0.0126	0.3107	0.6781
Brugia malayi	Dopamine receptor	0.0126	0.3107	0.3098
Brugia malayi	neuropeptide F receptor	0.0126	0.3107	0.3098
Schistosoma mansoni	neuropeptide F-like receptor	0.0126	0.3107	1
Schistosoma mansoni	hypothetical protein	0.0126	0.3107	1
Echinococcus multilocularis	dro:myosuppressin receptor	0.0126	0.3107	1
Echinococcus multilocularis	neuropeptide receptor	0.0126	0.3107	1
Echinococcus multilocularis	serotonin receptor	0.0126	0.3107	1
Brugia malayi	Adenylyl cyclase protein	0.0058	0.0993	0.0808
Brugia malayi	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Brugia malayi	putative neuropeptide receptor NPR1	0.0126	0.3107	0.3098
Schistosoma mansoni	replication factor A 1 rfa1	0.0068	0.1313	0.3727
Onchocerca volvulus		0.0126	0.3107	0.6781
Schistosoma mansoni	neuropeptide receptor	0.0126	0.3107	1
Brugia malayi	gonadotropin-releasing hormone receptor 2	0.0126	0.3107	0.3098
Schistosoma mansoni	opsin-like receptor	0.0126	0.3107	1
Echinococcus granulosus	tm gpcr rhodopsin	0.0126	0.3107	1
Onchocerca volvulus		0.0126	0.3107	0.6781
Echinococcus multilocularis	allatostatin A receptor	0.0126	0.3107	1
Trichomonas vaginalis	replication factor A 1, rfa1, putative	0.0065	0.1209	0.6264
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0126	0.3107	1
Echinococcus granulosus	tm gpcr rhodopsin	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Brugia malayi	ribonucleoside-diphosphate reductase large chain, putative	0.0084	0.1802	0.1684
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0126	0.3107	1
Brugia malayi	Tachykinin-like peptides receptor 99D	0.0126	0.3107	0.3098
Schistosoma mansoni	hypothetical protein	0.0126	0.3107	1
Echinococcus granulosus	neuropeptide receptor	0.0126	0.3107	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0049	0.073	0.0523
Plasmodium falciparum	ribonucleoside-diphosphate reductase large subunit, putative	0.0084	0.1802	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Trichomonas vaginalis	replication factor A 1, rfa1, putative	0.0068	0.1313	0.6919
Entamoeba histolytica	replication factor A protein 1, putative	0.0029	0.011	0.5
Mycobacterium ulcerans	ribonucleotide-diphosphate reductase subunit alpha	0.0349	1	0.5
Loa Loa (eye worm)	G-protein coupled receptor	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0095	0.2136	0.2046
Echinococcus granulosus	orexin receptor type 2	0.0126	0.3107	1
Loa Loa (eye worm)	G-protein-linked acetylcholine receptor protein 2	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Schistosoma mansoni	amine GPCR	0.0126	0.3107	1
Brugia malayi	follicle stimulating hormone receptor	0.0126	0.3107	0.3098
Schistosoma mansoni	biogenic amine receptor	0.0126	0.3107	1
Brugia malayi	Unidentified vitellogenin-linked transcript protein 6, putative	0.0126	0.3107	0.3098
Echinococcus multilocularis	g-protein coupled receptor	0.0126	0.3107	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0049	0.073	0.0523
Echinococcus granulosus	rhodopsin orphan GPCR	0.0126	0.3107	1
Schistosoma mansoni	amine GPCR	0.0126	0.3107	1
Brugia malayi	Dopamine receptor protein 1, putative (partial)	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus granulosus	replication protein A 70 kDa DNA binding	0.0068	0.1313	0.1512
Onchocerca volvulus		0.0055	0.0917	0.0115
Echinococcus granulosus	rhodopsin orphan GPCR	0.0126	0.3107	1
Echinococcus multilocularis	neuropeptide Y receptor	0.0126	0.3107	1
Brugia malayi	larval opioid receptor	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus granulosus	g protein linked acetylcholine receptor gar 2a	0.0126	0.3107	1
Loa Loa (eye worm)	neuropeptide F receptor	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Schistosoma mansoni	histamine h1 receptor	0.0126	0.3107	1
Echinococcus multilocularis	segment polarity protein dishevelled	0.0095	0.2136	0.5407
Echinococcus granulosus	rhodopsin orphan GPCR	0.0126	0.3107	1
Echinococcus multilocularis	tachykinin peptides receptor 99D	0.0126	0.3107	1
Loa Loa (eye worm)	adenylyl cyclase 3	0.0137	0.3433	0.3451
Loa Loa (eye worm)	hypothetical protein	0.0332	0.9479	1
Loa Loa (eye worm)	G-protein coupled receptor	0.0126	0.3107	0.3098
Echinococcus granulosus	alpha 1A adrenergic receptor	0.0126	0.3107	1
Brugia malayi	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0049	0.073	0.0523
Echinococcus multilocularis	neuropeptide s receptor	0.0126	0.3107	1
Schistosoma mansoni	adenoreceptor	0.0126	0.3107	1
Echinococcus granulosus	G protein coupled 5 hydroxytryptamine receptor	0.0126	0.3107	1
Brugia malayi	hypothetical protein	0.0332	0.9479	1
Echinococcus multilocularis	neuropeptide receptor	0.0126	0.3107	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0049	0.073	0.0523
Treponema pallidum	ribonucleotide-diphosphate reductase subunit alpha	0.0084	0.1802	0.5
Schistosoma mansoni	dishevelled	0.0085	0.1828	0.5527
Onchocerca volvulus		0.0126	0.3107	0.6781
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0158	0.4088	0.4161
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	g protein coupled receptor	0.0126	0.3107	1
Brugia malayi	G-protein coupled receptor	0.0126	0.3107	0.3098
Echinococcus multilocularis	7TM GPCR, rhodopsin	0.0126	0.3107	1
Schistosoma mansoni	biogenic amine (octopamine/dopamine) receptor	0.0126	0.3107	1
Brugia malayi	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus granulosus	neuropeptide receptor	0.0126	0.3107	1
Echinococcus granulosus	segment polarity protein dishevelled	0.0095	0.2136	0.5407
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	0.0126	0.3107	1
Onchocerca volvulus		0.0126	0.3107	0.6781
Wolbachia endosymbiont of Brugia malayi	ribonucleotide-diphosphate reductase subunit alpha	0.0084	0.1802	0.5
Trypanosoma cruzi	ribonucleoside-diphosphate reductase large chain, putative	0.0084	0.1802	1
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0126	0.3107	1
Echinococcus granulosus	g protein coupled receptor	0.0126	0.3107	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0126	0.3107	1
Echinococcus granulosus	7tm_1 domain containing protein	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	5-hydroxytryptamine 2C receptor	0.0126	0.3107	0.3098
Loa Loa (eye worm)	TYRA-2 protein	0.0126	0.3107	0.3098
Schistosoma mansoni	rhodopsin-like orphan GPCR	0.0126	0.3107	1
Onchocerca volvulus	Adenylate cyclase type 2 homolog	0.0058	0.0993	0.0347
Brugia malayi	Dopamine receptor protein 2	0.0126	0.3107	0.3098
Brugia malayi	RE15519p	0.0126	0.3107	0.3098
Brugia malayi	Melatonin receptor type 1A	0.0126	0.3107	0.3098
Echinococcus granulosus	neuropeptides capa receptor	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	sex peptide receptor	0.0126	0.3107	1
Echinococcus granulosus	hypothetical protein	0.0126	0.3107	1
Schistosoma mansoni	myosin xvIII	0.0126	0.3107	1
Echinococcus multilocularis	neuropeptide Y receptor	0.0126	0.3107	1
Echinococcus granulosus	sex peptide receptor	0.0126	0.3107	1
Echinococcus granulosus	pyroglutamylated rfamide peptide receptor	0.0126	0.3107	1
Schistosoma mansoni	biogenic amine receptor	0.0126	0.3107	1
Onchocerca volvulus	Dopamine\/Ecdysteroid receptor homolog	0.0126	0.3107	0.6781
Onchocerca volvulus		0.0126	0.3107	0.6781
Leishmania major	ribonucleoside-diphosphate reductase large chain, putative	0.0084	0.1802	1
Echinococcus granulosus	ribonucleoside diphosphate reductase large	0.0084	0.1802	0.3826
Brugia malayi	G-protein-linked acetylcholine receptor protein 2, putative	0.0126	0.3107	0.3098
Schistosoma mansoni	hypothetical protein	0.0126	0.3107	1
Mycobacterium tuberculosis	Ribonucleoside-diphosphate reductase (alpha chain) NrdE (ribonucleotide reductase small subunit) (R1F protein)	0.0349	1	1
Onchocerca volvulus		0.0126	0.3107	0.6781
Trichomonas vaginalis	ribonucleoside-diphosphate reductase alpha chain, putative	0.0084	0.1802	1
Onchocerca volvulus	Neuropeptide F receptor homolog	0.0126	0.3107	0.6781
Loa Loa (eye worm)	gonadotropin-releasing hormone receptor 2	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Schistosoma mansoni	biogenic amine (dopamine) receptor	0.0126	0.3107	1
Schistosoma mansoni	biogenic amine receptor	0.0126	0.3107	1
Brugia malayi	ORL1-like opioid receptor	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Schistosoma mansoni	amine GPCR	0.0126	0.3107	1
Echinococcus multilocularis	orexin receptor type 2	0.0126	0.3107	1
Echinococcus granulosus	growth hormone secretagogue receptor type 1	0.0126	0.3107	1
Echinococcus granulosus	serotonin receptor	0.0126	0.3107	1
Echinococcus multilocularis	g protein linked acetylcholine receptor gar 2a	0.0126	0.3107	1
Echinococcus granulosus	neuropeptides capa receptor	0.0126	0.3107	1
Onchocerca volvulus		0.0126	0.3107	0.6781
Trypanosoma cruzi	Replication factor A protein 1	0.0033	0.0214	0.1188
Echinococcus multilocularis	neuropeptide receptor A26	0.0126	0.3107	1
Echinococcus multilocularis	neuropeptides capa receptor	0.0126	0.3107	1
Brugia malayi	Dopamine receptor protein 1	0.0126	0.3107	0.3098
Echinococcus granulosus	g protein coupled receptor	0.0126	0.3107	1
Echinococcus granulosus	neuropeptide receptor A26	0.0126	0.3107	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.0126	0.3107	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Chlamydia trachomatis	ribonucleoside-diphosphate reductase subunit alpha	0.0084	0.1802	0.5
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Toxoplasma gondii	ribonucleoside-diphosphate reductase large chain	0.0084	0.1802	1
Echinococcus multilocularis	neuropeptides capa receptor	0.0126	0.3107	1
Schistosoma mansoni	neuropeptide receptor	0.0126	0.3107	1
Onchocerca volvulus	Putative replication factor A 73 kDa subunit	0.0061	0.1091	0.0645
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	somatostatin receptor	0.0126	0.3107	1
Schistosoma mansoni	peptide (allatostatin)-like receptor	0.0126	0.3107	1
Brugia malayi	putative neuropeptide receptor	0.0126	0.3107	0.3098
Brugia malayi	neuropeptide F receptor	0.0126	0.3107	0.3098
Schistosoma mansoni	neuropeptide receptor	0.0126	0.3107	1
Onchocerca volvulus		0.0126	0.3107	0.6781
Echinococcus multilocularis	fmrfamide receptor	0.0126	0.3107	1
Schistosoma mansoni	histamine-responsive GPCR (AAF21638)	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Echinococcus multilocularis	g protein coupled receptor	0.0126	0.3107	1
Echinococcus granulosus	g-protein coupled receptor	0.0126	0.3107	1
Onchocerca volvulus		0.0126	0.3107	0.6781
Schistosoma mansoni	amine GPCR	0.0126	0.3107	1
Echinococcus granulosus	rhodopsin orphan GPCR	0.0126	0.3107	1
Echinococcus granulosus	segment polarity protein dishevelled	0.0095	0.2136	0.5407
Onchocerca volvulus		0.0126	0.3107	0.6781
Echinococcus multilocularis	serotonin receptor	0.0126	0.3107	1
Echinococcus multilocularis	replication protein A 70 kDa DNA binding	0.0068	0.1313	0.1512
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0993	0.0808
Loa Loa (eye worm)	neuropeptide F receptor	0.0126	0.3107	0.3098
Brugia malayi	AKH receptor	0.0126	0.3107	0.3098
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0126	0.3107	0.3098
Echinococcus granulosus	dro:myosuppressin receptor	0.0126	0.3107	1
Echinococcus multilocularis	rhodopsin orphan GPCR	0.0126	0.3107	1
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098
Loa Loa (eye worm)	hypothetical protein	0.0126	0.3107	0.3098

Activities

Activity type	Activity value	Assay description	Source	Reference
Change in DA synthesis (functional)	= 104 %	Effect on Dopamine synthesis in rat Striatum(ST), measured as accumulation of DOPA(L-3,4-dihydroxyphenylalanine) at a peroral dose of 10 mg/kg	ChEMBL.	10602703
Change in DA synthesis (functional)	= 128 %	Effect on Dopamine synthesis in rat Hippocampus(HI), measured as accumulation of DOPA(L-3,4-dihydroxyphenylalanine) at a peroral dose of 10 mg/kg	ChEMBL.	10602703
Ki (binding)	= 1.8 nM	Binding affinity at Dopamine receptor D4 in CHO cells by radioligand displacement.	ChEMBL.	10602703
Ki (binding)	= 1.8 nM	Binding affinity at Dopamine receptor D4 in CHO cells by radioligand displacement.	ChEMBL.	10602703
Ki (binding)	= 572 nM	Binding affinity at Dopamine receptor D2 in CHO cells by radioligand displacement.	ChEMBL.	10602703
Ki (binding)	= 572 nM	Binding affinity at Dopamine receptor D2 in CHO cells by radioligand displacement.	ChEMBL.	10602703
Ki (binding)	> 3030 nM	Binding affinity at Dopamine receptor D3 in CHO cells by radioligand displacement.	ChEMBL.	10602703
Ki (binding)	> 3030 nM	Binding affinity at Dopamine receptor D3 in CHO cells by radioligand displacement.	ChEMBL.	10602703

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: CHEMBL149596
PubChem: 11792163

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 255343