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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 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	protriptyline
Molecular formula	C19H21N
IUPAC name	N-methyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)propan-1-amine
Molecular weight	263.384
Hydrogen bond acceptor	1
Hydrogen bond donor	1
XlogP	4.4
Synonyms	NSC169912 3-(5H-Dibenzo[a,d]cyclohepten-5-yl)-N-methyl-1-propanamine Protriptilina [INN-Spanish] 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N-methyl- PROTRYPTYLINE HYDROCHLORIDE AC-15971 Triptyl BDBM50176062 CAS-1225-55-4 D08447 Lopac-P-8813 N-3-(5H-Dibenzo(a,d)cyclohepten-5-yl)propyl-N-methylamine NCGC00015851-05 NCGC00024439-03 Prestwick0_000930 438-60-8 Protriptyline (INN) 5H-Dibenzo[a,d]cycloheptene-5-propanamine, N-methyl- SCHEMBL34267 AKOS015962184 Vivactil (Salt/Mix) BRD-K42098891-003-03-1 EINECS 207-119-9 Maximed N-Methyl-5H-dibenzo[a,d]cycloheptene-5-propylamine Novo-Tripramine 3-(11H-dibenzo[1,2-a:1',2'-e][7]annulen-11-yl)-N-methylpropan-1-amine Prestwick3_000930 5-(3-Methylaminopropyl)-5H-Dibenzo[a,d]cycloheptene Protriptylinum [INN-Latin] AB00489964 Triptil Apo-Imipramine ZINC1530764 BWPIARFWQZKAIA-UHFFFAOYSA-N Concordin (Salt/Mix) Impril MK 240 NCGC00015851-03 NCGC00015851-06 PDSP1_001390 3-(5H-Dibenzo[a,d]cyclohepten-5-yl)-N-methyl-1-propanamine # Protriptylin 5H-Dibenzo(a,d)cycloheptene-5-propylamine, N-methyl- Rhotrimine AC1L1JCC UNII-4NDU154T12 BIDD:PXR0157 CCG-205054 DB00344 Lopac0_000974 N-Methyl-5H-dibenzo(a,d)cycloheptene-5-propylamine Normethyl EX4442 Prestwick1_000930 4NDU154T12 Protriptyline [INN:BAN] 5H-Dibenzo[a,d]cycloheptene-5-propylamine, N-methyl- SPBio_003019 Amimetilina Vivactil (TN) BRN 2217411 CHEMBL668 GTPL7285 MCULE-6023848462 NCGC00015851-01 Novopramine 3-(11H-dibenzo[[?],[?]][7]annulen-11-yl)-N-methyl-propan-1-amine Protriptilina Protryptyline AB00489964_10 Triptil hydrochloride Apo-Trimip C07408 D00MYQ L000913 MK-240 NCGC00015851-04 NCGC00015851-07 PDSP2_001374 3-(5H-dibenzo[a,d][7]annulen-5-yl)-N-methylpropan-1-amine 5H-Dibenzo[a, d]cycloheptene-5-propanamine, N-methyl-, hydrochloride SBI-0050947.P002 ACM438608 Vivactil BPBio1_000924 CHEBI:8597 DTXSID0023535 LS-60771 N-Methyl-5H-dibenzo[a,d]cycloheptene-5-propanamine Novo-Doxepin 1225-55-4 (HYDROCHLORIDE) Prestwick2_000930 5-(3-Methylaminopropyl)-5H-dibenzo(a,d)cycloheptene Protriptylinum 7-(3-Methylaminopropyl)-1,2:5,6-dibenzocycloheptatriene Triadapin 5 AN-5942 Vivactyl BSPBio_000840 Concordin HSDB 3391 methyl(3-{tricyclo[9.4.0.0;{3,8}]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-2-yl}propyl)amine NCGC00015851-02 [ Show all ]
Inchi Key	BWPIARFWQZKAIA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H21N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-10,12-13,19-20H,6,11,14H2,1H3
PubChem CID	4976
ChEMBL	CHEMBL668
IUPHAR	N/A
BindingDB	50176062
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Potency	158.5 nM	PubChem BioAssay data set	ChEMBL
Potency	398.1 nM	PubChem BioAssay data set	ChEMBL

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