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GPCR

Name	5-hydroxytryptamine receptor 6
Species	Homo sapiens (Human)
Gene	HTR6
Synonym	5-HT6 receptor 5-hydroxytryptamine (serotonin) receptor 6, G protein-coupled 5-HT-6 serotonin receptor 6 ST-B17 5-HT6 [ Show all ]
Disease	Schizophrenia Obesity Neurological disease Neurodegenerative disease Emesis Cognitive disorders Unspecified Anxiety disorder Alzheimer disease; Dementia Alzheimer disease; Anxiety disorder Alzheimer disease [ Show all ]
Length	440
Amino acid sequence	MVPEPGPTANSTPAWGAGPPSAPGGSGWVAAALCVVIALTAAANSLLIALICTQPALRNTSNFFLVSLFTSDLMVGLVVMPPAMLNALYGRWVLARGLCLLWTAFDVMCCSASILNLCLISLDRYLLILSPLRYKLRMTPLRALALVLGAWSLAALASFLPLLLGWHELGHARPPVPGQCRLLASLPFVLVASGLTFFLPSGAICFTYCRILLAARKQAVQVASLTTGMASQASETLQVPRTPRPGVESADSRRLATKHSRKALKASLTLGILLGMFFVTWLPFFVANIVQAVCDCISPGLFDVLTWLGYCNSTMNPIIYPLFMRDFKRALGRFLPCPRCPRERQASLASPSLRTSHSGPRPGLSLQQVLPLPLPPDSDSDSDAGSGGSSGLRLTAQLLLPGEATQDPPLPTRAAAAVNFFNIDPAEPELRPHPLGIPTN
UniProt	P50406
Protein Data Bank	N/A
GPCR-HGmod model	P50406
3D structure model	This predicted structure model is from GPCR-EXP P50406.
BioLiP	N/A
Therapeutic Target Database	T16691
ChEMBL	CHEMBL3371
IUPHAR	11
DrugBank	BE0000945

Ligand

Name	methylphenidate
Molecular formula	C14H19NO2
IUPAC name	methyl 2-phenyl-2-piperidin-2-ylacetate
Molecular weight	233.311
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	0.2
Synonyms	CS-4657 SBI-0206868.P001 DTXSID5023299 Jornay PM (a.k.a. HLD200) Methyl (2-phenyl-2-(2-piperidyl)acetate) Methyl alpha-phenyl-alpha-2-piperidinylacetate Methylin .alpha.-Phenyl-2-piperidineacetic acid methyl ester METHYLPHENIDATE (SEE ALSO: METHYLPHENIDATE HYDROCHLORIDE, CAS 298-59-9, NTPNO 10266-R) AKOS022506757 MethyPatch BRD-A19585813-003-01-7 phenyl-piperidin-2-yl-acetic acid methyl ester Centedrine (Salt/Mix) Ritalin LA (TN) Ritaline D04999 Equasym (TN) Meridil Methyl .alpha.-phenyl-2-piperidine-acetate Methyl phenidyl acetate Methylin ER 2-Piperidineacetic acid, alpha-phenyl-, methyl ester Methylphenidate [INN:BAN] API0008866 Metilfenidato [Italian] Calocain Riphenidate CHEMBL796 Concerta, Methylin, Ritalin Rubifen DB00422 HSDB 3126 Metadate ER methyl 2-phenyl-2-piperidin-2-ylacetate methyl phenyl(piperidin-2-yl)acetate Methylphenidan AB01563134_01 Methylphenidatum [INN-Latin] BDBM50062912 NCI-C56280 Centedrin Ritalin (TN) d-methylphenidate HCl SCHEMBL37178 DUGOZIWVEXMGBE-UHFFFAOYSA-N L001307 Methyl .alpha.-phenyl-.alpha.-(2-piperidyl)acetate methyl alpha-piperid-2-ylphenylacetate Methylin (Salt/Mix) 113-45-1 Methylphenidate (USAN/INN) alpha-Phenyl-2-piperidineacetic acid methyl ester Metilfenidato C 4311 Plimasine Centredin Ritalin SR Ritaline (Salt/Mix) Daytrana FT-0700534 Metadate Methyl .alpha.-phenyl-2-piperidineacetate Methyl phenidylacetate Methylofenidan 298-59-9 (hydrochloride) Methylphenidate [USAN:INN:BAN] Attenta (TN) Motiron (TN) Centedein Ritalin Concerta Cotempla XR-ODT Rubifen (TN) DEA No. 1724 HY-B1091 Metadate ER (TN) Methyl alpha-phenyl-alpha-(2-piperidyl)acetate Methylfenidan AC1L1HJM Methylphenidylacetate hydrochloride Biphentin (TN) Phenidylate Centedrin (Salt/Mix) Ritalin LA Ritalin-SR D02PPN Tsentedrin EINECS 204-028-6 LS-565 Methyl .alpha.-phenyl-.alpha.-2-piperidinylacetate Methyl phenidate Methylin (TN) 2-Piperidineacetic acid, .alpha.-phenyl-, methyl ester Methylphenidate HCl alpha-Phenyl-alpha-(2-piperidyl)acetic acid methyl ester Metilfenidato [INN-Spanish] C07196 PMS-Methylphenidate CHEBI:84276 Ritcher works Daytrana (TN) GTPL7236 Metadate CD Methyl 2-phenyl-2-(piperidin-2-yl)acetate Methyl phenyl(2-piperidinyl)acetate # Methylphen 4311/B Ciba Methylphenidatum BCP18286 NCGC00248587-01 Centedein (Salt/Mix) Ritalin (Salt/Mix) Concerta (TN) [ Show all ]
Inchi Key	DUGOZIWVEXMGBE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C14H19NO2/c1-17-14(16)13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h2-4,7-8,12-13,15H,5-6,9-10H2,1H3
PubChem CID	4158
ChEMBL	N/A
IUPHAR	N/A
BindingDB	N/A
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	<10000.0 nM	http://pdsp.med.unc.edu/pdsp.php	PDSP

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