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GPCR

Name	5-hydroxytryptamine receptor 4
Species	Homo sapiens (Human)
Gene	HTR4
Synonym	5-HT-4 5-hydroxytryptamine (serotonin) receptor 4, G protein-coupled 5-HT4 receptor 5-HT4 serotonin receptor 4
Disease	N/A
Length	388
Amino acid sequence	MDKLDANVSSEEGFGSVEKVVLLTFLSTVILMAILGNLLVMVAVCWDRQLRKIKTNYFIVSLAFADLLVSVLVMPFGAIELVQDIWIYGEVFCLVRTSLDVLLTTASIFHLCCISLDRYYAICCQPLVYRNKMTPLRIALMLGGCWVIPTFISFLPIMQGWNNIGIIDLIEKRKFNQNSNSTYCVFMVNKPYAITCSVVAFYIPFLLMVLAYYRIYVTAKEHAHQIQMLQRAGASSESRPQSADQHSTHRMRTETKAAKTLCIIMGCFCLCWAPFFVTNIVDPFIDYTVPGQVWTAFLWLGYINSGLNPFLYAFLNKSFRRAFLIILCCDDERYRRPSILGQTVPCSTTTINGSTHVLRDAVECGGQWESQCHPPATSPLVAAQPSDT
UniProt	Q13639
Protein Data Bank	N/A
GPCR-HGmod model	Q13639
3D structure model	This predicted structure model is from GPCR-EXP Q13639.
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL1875
IUPHAR	9
DrugBank	BE0000084

Ligand

Name	CHEMBL198226
Molecular formula	C48H56Cl2N6O9
IUPAC name	2-[4-[3-[7-[3-[[1-[2-(4-amino-5-chloro-2-methoxybenzoyl)oxyethyl]piperidin-4-yl]amino]-3-oxopropyl]dibenzofuran-3-yl]propanoylamino]piperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate
Molecular weight	931.909
Hydrogen bond acceptor	13
Hydrogen bond donor	4
XlogP	6.8
Synonyms	BDBM50174428 1-[2-(3-amino-4-chloro-2-methoxyphenylcarbonyloxy)ethyl]-4-{2-[7-(2-{1-[2-(4-amino-5-chloro-2-methoxyphenylcarbonyloxy)ethyl]hexahydro-4-pyridinylcarbamoyl}ethyl)dibenzo[b,d]furan-3-yl]ethylcarboxamido}hexahydropyridine
Inchi Key	DCUAGYBZQCTXFV-UHFFFAOYSA-N
Inchi ID	InChI=1S/C48H56Cl2N6O9/c1-61-41-27-39(51)37(49)25-35(41)47(59)63-21-19-55-15-11-31(12-16-55)53-45(57)9-5-29-3-7-33-34-8-4-30(24-44(34)65-43(33)23-29)6-10-46(58)54-32-13-17-56(18-14-32)20-22-64-48(60)36-26-38(50)40(52)28-42(36)62-2/h3-4,7-8,23-28,31-32H,5-6,9-22,51-52H2,1-2H3,(H,53,57)(H,54,58)
PubChem CID	44404969
ChEMBL	CHEMBL198226
IUPHAR	N/A
BindingDB	50174428
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
cAMP	23.0 %	PMID16190749	ChEMBL
Ki	47.0 nM	PMID16190749	BindingDB,ChEMBL

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