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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 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	CHEMBL99578
Molecular formula	C16H23N5O2
IUPAC name	3-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-oxobenzimidazole-1-carboxamide
Molecular weight	317.393
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	0.9
Synonyms	3-Methyl-N-[2-(4-methylpiperazino)ethyl]-2-oxo-2,3-dihydro-1H-benzimidazole-1-carboxamide 3-Methyl-2-oxo-2,3-dihydro-benzoimidazole-1-carboxylic acid [2-(4-methyl-piperazin-1-yl)-ethyl]-amide BDBM50079314
Inchi Key	CZHCUQQIVUYRAS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H23N5O2/c1-18-9-11-20(12-10-18)8-7-17-15(22)21-14-6-4-3-5-13(14)19(2)16(21)23/h3-6H,7-12H2,1-2H3,(H,17,22)
PubChem CID	10543526
ChEMBL	CHEMBL99578
IUPHAR	N/A
BindingDB	50079314
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	0.42 -	PMID10425096	ChEMBL
Ki	305.8 nM	PMID10425096	ChEMBL
Ki	306.0 nM	PMID10425096	BindingDB
pKb	>6.0 -	PMID10425096	ChEMBL

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