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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	Telenzepine
Molecular formula	C19H22N4O2S
IUPAC name	1-methyl-10-[2-(4-methylpiperazin-1-yl)acetyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one
Molecular weight	370.471
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	1.7
Synonyms	BSPBio_000266 CHEBI:92110 DSSTox_RID_80752 Lopac-T-122 NCGC00015987-05 Prestwick0_000303 Spectrum3_001839 Telenzepinum 3-methyl-4-(2-(4-methylpiperazin-1-yl)acetyl)-4H-benzo[b]thieno[3,4-e][1,4]diazepin-10(9H)-one ZINC19796161 BDBM82376 C19H22N4O2S CTK6I3128 HMS2089M03 MLS000069348 NCGC00015987-09 Prestwick3_000303 Telenzepine dihydrochloride hydrate (+)-Telenzepine Tox21 110274 4,9-Dihydro-3-methyl-4-[(4-methyl-1-piperazinyl)acetyl]-10H-thieno[3,4-b][1,5]benzodiazepin-10-one dihydrochloride 80880-90-6 BRD-K06147391-300-03-5 CAS_80880-90-6 DSSTox_CID_25209 KBio3_003022 NCGC00015987-03 NCGC00025013-03 SMR000058848 Telenzepino 0990EG3K10 UNII-0990EG3K10 [3H](+)telenzepine AC1L1K8Q BSPBio_003517 DTXSID5045209 Lopac0_001204 NCGC00015987-06 Prestwick1_000303 Telenzepinum [Latin] 3-methyl-4-[(4-methylpiperazin-1-yl)acetyl]-4,9-dihydro-10h-thieno[3,4-b][1,5]benzodiazepin-10-one BPBio1_000294 CAS-147416-96-4 D08XDK HMS2235P06 NCGC00015987-01 NCGC00025013-01 SBI-0051171.P002 Telenzepine hydrochloride (-)-Telenzepine Tox21_110274 4,9-Dihydro-3-methyl-4alpha-[(4-methyl-1-piperazinyl)acetyl]-10H-thieno[3,4-b][1,5]benzodiazepin-10-one BRD-K06147391-300-04-3 CCG-205278 DSSTox_GSID_45209 L001013 NCGC00015987-04 NSC_5387 SPBio_002485 Telenzepino [Spanish] 1-methyl-10-[2-(4-methylpiperazin-1-yl)acetyl]-5H-thieno[3,4-b][1,5]benzodiazepin-4-one VSWPGAIWKHPTKX-UHFFFAOYSA-N API0015667 BY-802 CHEMBL253978 GTPL8594 LS-177594 NCGC00015987-07 Prestwick2_000303 Telenzepine dihydrochloide Tocris-1122 4,9-Dihydro-3-methyl-4-((4-methyl-1-piperazinyl)acetyl)-10H-thieno(3,4-b)(1,5)benzodiazepin-10-one 4,9-Dihydro-3-methyl-4beta-[(4-methyl-1-piperazinyl)acetyl]-10H-thieno[3,4-b][1,5]benzodiazepin-10-one BRD-K06147391-003-01-9 CAS-80880-90-6 D0FX4J HMS3374A10 NCGC00015987-02 NCGC00025013-02 SCHEMBL49345 Telenzepine [INN] Tox21_110274_1 [ Show all ]
Inchi Key	VSWPGAIWKHPTKX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H22N4O2S/c1-13-18-14(12-26-13)19(25)20-15-5-3-4-6-16(15)23(18)17(24)11-22-9-7-21(2)8-10-22/h3-6,12H,7-11H2,1-2H3,(H,20,25)
PubChem CID	5387
ChEMBL	CHEMBL253978
IUPHAR	8594
BindingDB	82376
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	0.398108 nM	PMID2704371	IUPHAR
Ki	1.29 nM	PMID2250662	BindingDB
Ki	1.8 nM	PMID2066986	BindingDB,ChEMBL
Potency	28.2 nM	PubChem BioAssay data set	ChEMBL
Potency	31.6 nM	PubChem BioAssay data set	ChEMBL

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