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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 4
Species	Cavia porcellus (Guinea pig)
Gene	HTR4
Synonym	5-HT-4 5-HT4 Serotonin receptor 4
Disease	N/A for non-human GPCRs
Length	388
Amino acid sequence	MDKLDANVSSKEGFGSVEKVVLLTFLSAVILMAILGNLLVMVAVCRDRQLRKIKTNYFIVSLAFADLLVSVLVMPFGAIELVQDIWVYGEMFCLVRTSLDVLLTTASIFHLCCISLDRYYAICCQPLVYRNKMTPLRIALMLGGCWVIPMFISFLPIMQGWNNIGIVDLIEKRKFNQNSNSTYCVFMVNKPYAITCSVVAFYIPFLLMVLAYYRIYVTAKEHARQIQVLQRAGAPAEGRPQPADQHSTHRMRTETKAAKTLCIIMGCFCLCWAPFFVTNIVDPFIDYTVPGQLWTAFLWLGYINSGLNPFLYAFLNKSFRRAFLIILCCDDERYRRPSILGQTVPCSTTTINGSTHVLRDTVECGGQWESQCHPAASSPLVAAQPIDT
UniProt	O70528
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	CHEMBL5017
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL36558
Molecular formula	C21H29N3O
IUPAC name	6-[(1-ethylpiperidin-4-yl)methoxy]-2,3,4,5-tetrahydro-1H-azepino[3,2-c]quinoline
Molecular weight	339.483
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	4.4
Synonyms	BDBM50122721 6-(1-Ethyl-piperidin-4-ylmethoxy)-8,9,10,11-tetrahydro-7H-5,11-diaza-cyclohepta[a]naphthalene
Inchi Key	AMRCESOKVVHRSH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H29N3O/c1-2-24-13-10-16(11-14-24)15-25-21-18-8-5-6-12-22-20(18)17-7-3-4-9-19(17)23-21/h3-4,7,9,16,22H,2,5-6,8,10-15H2,1H3
PubChem CID	9881054
ChEMBL	CHEMBL36558
IUPHAR	N/A
BindingDB	50122721
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Inhibition	51.0 %	PMID12502367	ChEMBL
Inhibition	100.0 %	PMID12502367	ChEMBL
Ki	10.7 nM	PMID12502367	ChEMBL
Ki	11.0 nM	PMID12502367	BindingDB

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