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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 5A
Species	Mus musculus (Mouse)
Gene	Htr5a
Synonym	MR22 Htr5 5HT5- 5-hydroxytryptamine (serotonin) receptor 5A, G protein-coupled 5-HT5alpha 5-HT5A receptor 5-HT5A 5-HT-5A 5-HT-5 Serotonin receptor 5A [ Show all ]
Disease	N/A for non-human GPCRs
Length	357
Amino acid sequence	MDLPVNLTSFSLSTPSSLEPNRSLDTEVLRPSRPFLSAFRVLVLTLLGFLAAATFTWNLLVLATILKVRTFHRVPHNLVASMAISDVLVAVLVMPLSLVHELSGRRWQLGRRLCQLWIACDVLCCTASIWNVTAIALDRYWSITRHLEYTLRTRKRVSNVMILLTWALSTVISLAPLLFGWGETYSEPSEECQVSREPSYTVFSTVGAFYLPLCVVLFVYWKIYRAAKFRMGSRKTNSVSPVPEAVEVKNATQHPQMVFTVRHATVTFQTEGDTWREQKEQRAALMVGILIGVFVLCWFPFFVTELISPLCSWDVPAIWKSIFLWLGYSNSFFNPLIYTAFNRSYSSAFKVFFSKQQ
UniProt	P30966
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	CHEMBL3597
IUPHAR	10
DrugBank	N/A

Ligand

Name	CHEMBL129163
Molecular formula	C21H22N2O
IUPAC name	1-phenyl-4-(1,3,4,9-tetrahydropyrido[3,4-b]indol-2-yl)butan-1-one
Molecular weight	318.42
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	3.6
Synonyms	BDBM50132112 1-Phenyl-4-(1,3,4,9-tetrahydro-beta-carbolin-2-yl)-butan-1-one
Inchi Key	SJUGUCWHNWWFDF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H22N2O/c24-21(16-7-2-1-3-8-16)11-6-13-23-14-12-18-17-9-4-5-10-19(17)22-20(18)15-23/h1-5,7-10,22H,6,11-15H2
PubChem CID	11045379
ChEMBL	CHEMBL129163
IUPHAR	N/A
BindingDB	50132112
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	550.0 nM	PMID12930153	BindingDB,ChEMBL

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