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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.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Muscarinic acetylcholine receptor M1
Species	Rattus norvegicus (Rat)
Gene	Chrm1
Synonym	cholinergic receptor, muscarinic 1 cholinergic receptor, muscarinic 1, CNS cholinergic receptor M1 muscarinic acetylcholine receptor M1 receptor M1R Chrm-1 [ Show all ]
Disease	N/A for non-human GPCRs
Length	460
Amino acid sequence	MNTSVPPAVSPNITVLAPGKGPWQVAFIGITTGLLSLATVTGNLLVLISFKVNTELKTVNNYFLLSLACADLIIGTFSMNLYTTYLLMGHWALGTLACDLWLALDYVASNASVMNLLLISFDRYFSVTRPLSYRAKRTPRRAALMIGLAWLVSFVLWAPAILFWQYLVGERTVLAGQCYIQFLSQPIITFGTAMAAFYLPVTVMCTLYWRIYRETENRARELAALQGSETPGKGGGSSSSSERSQPGAEGSPESPPGRCCRCCRAPRLLQAYSWKEEEEEDEGSMESLTSSEGEEPGSEVVIKMPMVDSEAQAPTKQPPKSSPNTVKRPTKKGRDRGGKGQKPRGKEQLAKRKTFSLVKEKKAARTLSAILLAFILTWTPYNIMVLVSTFCKDCVPETLWELGYWLCYVNSTVNPMCYALCNKAFRDTFRLLLLCRWDKRRWRKIPKRPGSVHRTPSRQC
UniProt	P08482
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	CHEMBL276
IUPHAR	13
DrugBank	N/A

Ligand

Name	CHEMBL126735
Molecular formula	C23H30N2
IUPAC name	N-benzhydryl-2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine
Molecular weight	334.507
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	4.7
Synonyms	BDBM50106312 Benzhydryl-[2-(8-methyl-8-aza-bicyclo[3.2.1]oct-3-yl)-ethyl]-amine N-benzhydryl-2-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine AC1L8IGX NCI60_039930
Inchi Key	ALPHRFUELPDGHE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H30N2/c1-25-21-12-13-22(25)17-18(16-21)14-15-24-23(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,18,21-24H,12-17H2,1H3
PubChem CID	401890
ChEMBL	CHEMBL126735
IUPHAR	N/A
BindingDB	50106312
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	340.0 nM	PMID11689080	BindingDB,ChEMBL

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