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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	D(3) dopamine receptor
Species	Homo sapiens (Human)
Gene	DRD3
Synonym	dopaminergic receptor D3 D3R D3 receptor dopamine D3 receptor
Disease	Unspecified Emesis; Gastric motility disorder Female sexual dysfunction Male sexual disorders Psychotic disorders Cocaine addiction Schizophrenia Drug abuse [ Show all ]
Length	400
Amino acid sequence	MASLSQLSSHLNYTCGAENSTGASQARPHAYYALSYCALILAIVFGNGLVCMAVLKERALQTTTNYLVVSLAVADLLVATLVMPWVVYLEVTGGVWNFSRICCDVFVTLDVMMCTASILNLCAISIDRYTAVVMPVHYQHGTGQSSCRRVALMITAVWVLAFAVSCPLLFGFNTTGDPTVCSISNPDFVIYSSVVSFYLPFGVTVLVYARIYVVLKQRRRKRILTRQNSQCNSVRPGFPQQTLSPDPAHLELKRYYSICQDTALGGPGFQERGGELKREEKTRNSLSPTIAPKLSLEVRKLSNGRLSTSLKLGPLQPRGVPLREKKATQMVAIVLGAFIVCWLPFFLTHVLNTHCQTCHVSPELYSATTWLGYVNSALNPVIYTTFNIEFRKAFLKILSC
UniProt	P35462
Protein Data Bank	3pbl
GPCR-HGmod model	P35462
3D structure model	This structure is from PDB ID 3pbl.
BioLiP	BL0191566, BL0191567
Therapeutic Target Database	T02551
ChEMBL	CHEMBL234
IUPHAR	216
DrugBank	BE0000581

Ligand

Name	Moperone
Molecular formula	C22H26FNO2
IUPAC name	1-(4-fluorophenyl)-4-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]butan-1-one
Molecular weight	355.453
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	3.0
Synonyms	EINECS 213-887-6 Moperona Mopiperone SCHEMBL34340 1050-79-9 API0003426 CAS_1050-79-9 L000665 Moperone (INN) omega-(4-Hydroxy-4-p-tolylpiperidino)-p-fluorobutyrophenone 1-(4-Fluorophenyl)-4-[4-hydroxy-4-(4-methylphenyl)-1-piperidinyl]-1-butanone 4'-Fluoro-4-(4-hydroxy-4-p-tolylpiperidino)butyrophenone;4'-Fluoro-4-(4-hydroxy-4-p-tolylpiperidino)butyrophenone CTK8G1178 Meperon Moperonum p-Fluoro-4-(4'-hydroxy-4'-p-tolylpiperidino)butyrophenone 1-Butanone, 1-(4-fluorophenyl)-4-(4-hydroxy-4-(4-methylphenyl)-1-piperidinyl)- AGAHNABIDCTLHW-UHFFFAOYSA-N FT-0672517 Moperona [INN-Spanish] NCGC00188430-01 UNII-OU730881W5 3871-82-7 (hydrochloride) BDBM81486 CHEBI:135500 Luvatren Moperone HCl OU730881W5 1-(4-Fluorophenyl)-4-[4-hydroxy-4-(4-methylphenyl)-1-piperidinyl]-1-butanone # D02623 Methylperidol Moperonum [INN-Latin] R 1658 1-Butanone, 1-(4-fluorophenyl)-4-[4-hydroxy-4-(4-methylphenyl)-1-piperidinyl]- AKOS030254497 Butyrophenone, 4'-fluoro-4-(4-hydroxy-4-p-tolylpiperidino)- gamma-(4-hydroxy-4-p-methylphenylpiperidino)-p-fluorobutyrophenone NSC_4249 ZINC538026 1-(3'-p-Fluorobenzoylpropyl)-4-hydroxy-4-p-tolylpiperidine 4'-Fluoro-4-(4-hydroxy-4-p-tolylpiperidino)butyrophenone CHEMBL2104700 Luvatrena Moperone [INN] p-Fluoro-4-(4'-hydroxy-4'-p-methylphenylpiperidino)butyrophenone 1-(4-fluorophenyl)-4-[4-hydroxy-4-(4-methylphenyl)piperidin-1-yl]butan-1-one AC1L1HQP [ Show all ]
Inchi Key	AGAHNABIDCTLHW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H26FNO2/c1-17-4-8-19(9-5-17)22(26)12-15-24(16-13-22)14-2-3-21(25)18-6-10-20(23)11-7-18/h4-11,26H,2-3,12-16H2,1H3
PubChem CID	4249
ChEMBL	N/A
IUPHAR	N/A
BindingDB	81486
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	0.1 nM	PMID16135699	PDSP,BindingDB
Ki	1.0 nM	PMID16135699	PDSP,BindingDB

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