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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 1B
Species	Rattus norvegicus (Rat)
Gene	Htr1b
Synonym	HTR1D2 5-hydroxytryptamine (serotonin) receptor 1B, G protein-coupled 5-HT1Dbeta 5-HT1DB 5-HT1B serotonin receptor 5-HT1B receptor 5-HT1B 5-HT-1B Serotonin receptor 1B [ Show all ]
Disease	N/A for non-human GPCRs
Length	386
Amino acid sequence	MEEQGIQCAPPPPATSQTGVPLANLSHNCSADDYIYQDSIALPWKVLLVALLALITLATTLSNAFVIATVYRTRKLHTPANYLIASLAVTDLLVSILVMPISTMYTVTGRWTLGQVVCDFWLSSDITCCTASIMHLCVIALDRYWAITDAVDYSAKRTPKRAAIMIVLVWVFSISISLPPFFWRQAKAEEEVLDCFVNTDHVLYTVYSTVGAFYLPTLLLIALYGRIYVEARSRILKQTPNKTGKRLTRAQLITDSPGSTSSVTSINSRVPEVPSESGSPVYVNQVKVRVSDALLEKKKLMAARERKATKTLGIILGAFIVCWLPFFIISLVMPICKDACWFHMAIFDFFNWLGYLNSLINPIIYTMSNEDFKQAFHKLIRFKCTG
UniProt	P28564
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3459
IUPHAR	2
DrugBank	N/A

Ligand

Name	CHEMBL335010
Molecular formula	C22H26N2O2
IUPAC name	1-(2,3-dihydro-1,4-benzodioxin-5-yl)-4-(2,3-dihydro-1H-inden-2-ylmethyl)piperazine
Molecular weight	350.462
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	3.8
Synonyms	SCHEMBL9179406 2-[[4-[(2,3-Dihydro-1,4-benzodioxin)-5-yl]piperazin-1-yl]methyl]indan BDBM50407543
Inchi Key	CBDKXYNKQOGHRL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H26N2O2/c1-2-5-19-15-17(14-18(19)4-1)16-23-8-10-24(11-9-23)20-6-3-7-21-22(20)26-13-12-25-21/h1-7,17H,8-16H2
PubChem CID	9998026
ChEMBL	CHEMBL335010
IUPHAR	N/A
BindingDB	50407543
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	489.78 nM	PMID7562940	BindingDB,ChEMBL

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