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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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GPCR

Name	5-hydroxytryptamine receptor 1B
Species	Cricetulus griseus (Chinese hamster)
Gene	HTR1B
Synonym	5-HT-1B 5-HT1B Serotonin receptor 1B
Disease	N/A for non-human GPCRs
Length	386
Amino acid sequence	MEEQGIQCAPPPPAASQTGVPLVNLSHNCSAESHIYQDSIALPWKVLLVALLALITLATTLSNAFVIATVYRTRKLHTPANYLIASLAVTDLLVSILVMPVSTMYTVTGRWTLGQVVCDFWLSSDITCCTASIMHLCVIALDRYWAITDAVEYAAKRTPKRAAIMIALVWVFSISISLPPFFWRQAKAEEEVLTCLVNTDHVLYTVYSTGGAFYLPTLLLIALYGRIYVEARSRILKQTPNKTGKRLTRAQLITDSPGSTTSVTSINSRAPDLPSESGSPVYVNQVKVRVSDALLEKKKLMAARERKATKTLGIILGAFIVCWLPFFIISLVMPICKDACWFHMATLDFFNWLGYLNSLINPIIYTMSNEDFKQAFHKLIRFKCAG
UniProt	P46636
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	CHEMBL3707466
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	SCHEMBL943679
Molecular formula	C26H30N6O2
IUPAC name	N-[1-(2-methylpyrazol-3-yl)ethyl]-7-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]-1-benzofuran-2-carboxamide
Molecular weight	458.566
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	3.0
Synonyms	US8859534, 32 CHEMBL3650025 BDBM136346
Inchi Key	XOVZEOLIOJODHZ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C26H30N6O2/c1-19(22-9-12-28-30(22)2)29-26(33)24-18-20-6-5-8-23(25(20)34-24)32-16-14-31(15-17-32)13-10-21-7-3-4-11-27-21/h3-9,11-12,18-19H,10,13-17H2,1-2H3,(H,29,33)
PubChem CID	59636748
ChEMBL	CHEMBL3650025
IUPHAR	N/A
BindingDB	136346
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	280.0 nM	, None	BindingDB,ChEMBL

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