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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	CHEMBL99452
Molecular formula	C17H23N5O2
IUPAC name	3-cyclopropyl-N-[(4-methylpiperazin-1-yl)methyl]-2-oxobenzimidazole-1-carboxamide
Molecular weight	329.404
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	1.6
Synonyms	BDBM50079308 3-Cyclopropyl-2-oxo-2,3-dihydro-benzoimidazole-1-carboxylic acid (4-methyl-piperazin-1-ylmethyl)-amide
Inchi Key	CLWVDIOYXBAMQX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H23N5O2/c1-19-8-10-20(11-9-19)12-18-16(23)22-15-5-3-2-4-14(15)21(17(22)24)13-6-7-13/h2-5,13H,6-12H2,1H3,(H,18,23)
PubChem CID	10687803
ChEMBL	CHEMBL99452
IUPHAR	N/A
BindingDB	50079308
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Intrinsic activity	0.53 -	PMID10425096	ChEMBL
Ki	49.0 nM	PMID10425096	BindingDB
Ki	49.4 nM	PMID10425096	ChEMBL
pKb	6.19 -	PMID10425096	ChEMBL

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