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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Muscarinic acetylcholine receptor M4
Species	Rattus norvegicus (Rat)
Gene	Chrm4
Synonym	cholinergic receptor cholinergic receptor, muscarinic 4 Chrm-4 HM3 M4 receptor
Disease	N/A for non-human GPCRs
Length	478
Amino acid sequence	MXNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR
UniProt	P08485
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	CHEMBL317
IUPHAR	16
DrugBank	N/A

Ligand

Name	VU0359460
Molecular formula	C19H28N4O3S
IUPAC name	3-amino-N-tert-butyl-4-methyl-6-(2-morpholin-4-ylethoxy)thieno[2,3-b]pyridine-2-carboxamide
Molecular weight	392.518
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	3.0
Synonyms	CHEMBL1593296 3-amino-N-tert-butyl-4-methyl-6-[2-(4-morpholinyl)ethoxy]-2-thieno[2,3-b]pyridinecarboxamide BDBM48073 3-amino-N-tert-butyl-4-methyl-6-(2-morpholin-4-ylethoxy)thieno[2,3-b]pyridine-2-carboxamide cid_45142483 3-azanyl-N-tert-butyl-4-methyl-6-(2-morpholin-4-ylethoxy)thieno[2,3-b]pyridine-2-carboxamide 3-amino-N-tert-butyl-4-methyl-6-(2-morpholinoethoxy)thieno[2,3-b]pyridine-2-carboxamide [ Show all ]
Inchi Key	GKYMJPPLQWFUJW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H28N4O3S/c1-12-11-13(26-10-7-23-5-8-25-9-6-23)21-18-14(12)15(20)16(27-18)17(24)22-19(2,3)4/h11H,5-10,20H2,1-4H3,(H,22,24)
PubChem CID	45142483
ChEMBL	CHEMBL1593296
IUPHAR	N/A
BindingDB	48073
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	191.6 nM	, PubChem BioAssay data set	BindingDB,ChEMBL
EC50	8730.0 nM	N/A	BindingDB

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