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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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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	CHEMBL1762574
Molecular formula	C18H21N5O2S
IUPAC name	3-(benzenesulfonyl)-5,7-dimethyl-2-piperazin-1-ylpyrazolo[1,5-a]pyrimidine
Molecular weight	371.459
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	1.7
Synonyms	AKOS021678660 5,7-Dimethyl-3-(phenylsulfonyl)-2-piperazin-1-ylpyrazolo[1,5-a]pyrimidine ZINC71317063 BDBM50340734 MolPort-021-806-472 5,7-dimethyl-2-piperazinopyrazolo[1,5-a]pyrimidin-3-yl phenyl sulfone SCHEMBL8034006 [ Show all ]
Inchi Key	AADWHZPNHCHIAB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H21N5O2S/c1-13-12-14(2)23-17(20-13)16(18(21-23)22-10-8-19-9-11-22)26(24,25)15-6-4-3-5-7-15/h3-7,12,19H,8-11H2,1-2H3
PubChem CID	52915983
ChEMBL	CHEMBL1762574
IUPHAR	N/A
BindingDB	50340734
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	1380.0 nM	PMID21333408	BindingDB,ChEMBL

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