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GLASS

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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	CHEMBL380777
Molecular formula	C18H19N3O3S
IUPAC name	2,4-dimethyl-5-[3-(1,2,3,6-tetrahydropyridin-5-yl)indol-1-yl]sulfonyl-1,3-oxazole
Molecular weight	357.428
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	2.5
Synonyms	1-(2,4-Dimethyl-oxazole-5-sulfonyl)-3-(1,2,5,6-tetrahydro-pyridin-3-yl)-1H-indole BDBM50172288
Inchi Key	AHMBKTMJOBDXMV-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H19N3O3S/c1-12-18(24-13(2)20-12)25(22,23)21-11-16(14-6-5-9-19-10-14)15-7-3-4-8-17(15)21/h3-4,6-8,11,19H,5,9-10H2,1-2H3
PubChem CID	44403091
ChEMBL	CHEMBL380777
IUPHAR	N/A
BindingDB	50172288
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	58.0 nM	PMID16125933	BindingDB,ChEMBL

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