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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.
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GPCR

Name	Muscarinic acetylcholine receptor M1
Species	Homo sapiens (Human)
Gene	CHRM1
Synonym	cholinergic receptor cholinergic receptor, muscarinic 1 cholinergic receptor, muscarinic 1, CNS Chrm-1 M1 receptor M1R M1 muscarinic acetylcholine receptor [ Show all ]
Disease	Functional bowel syndrome; Irritable bowel syndrome Glaucoma Peptic ulcer Parkinsonism; Extrapyramidal disorders secondary to neuroleptic drug therapy Visceral spasms Parkinson's disease; Dystonia Parkinson's disease Neurological disease Neuropathic pain Overactive bladder disorder Excessive sweating; Stomach ulcer Cognitive disorders Chronic obstructive pulmonary disease Schizophrenia Schizophrenia; Dementia Schizophrenia; Schizoaffective disorders Unspecified Urinary incontinence Anesthesia Alzheimer disease Abdominal stomach pain; Irritable bowel syndrome [ Show all ]
Length	460
Amino acid sequence	MNTSAPPAVSPNITVLAPGKGPWQVAFIGITTGLLSLATVTGNLLVLISFKVNTELKTVNNYFLLSLACADLIIGTFSMNLYTTYLLMGHWALGTLACDLWLALDYVASNASVMNLLLISFDRYFSVTRPLSYRAKRTPRRAALMIGLAWLVSFVLWAPAILFWQYLVGERTVLAGQCYIQFLSQPIITFGTAMAAFYLPVTVMCTLYWRIYRETENRARELAALQGSETPGKGGGSSSSSERSQPGAEGSPETPPGRCCRCCRAPRLLQAYSWKEEEEEDEGSMESLTSSEGEEPGSEVVIKMPMVDPEAQAPTKQPPRSSPNTVKRPTKKGRDRAGKGQKPRGKEQLAKRKTFSLVKEKKAARTLSAILLAFILTWTPYNIMVLVSTFCKDCVPETLWELGYWLCYVNSTINPMCYALCNKAFRDTFRLLLLCRWDKRRWRKIPKRPGSVHRTPSRQC
UniProt	P11229
Protein Data Bank	5cxv
GPCR-HGmod model	P11229
3D structure model	This structure is from PDB ID 5cxv.
BioLiP	BL0339262, BL0339261, BL0339263
Therapeutic Target Database	T28893
ChEMBL	CHEMBL216
IUPHAR	13
DrugBank	BE0000092

Ligand

Name	hexahydrosiladifenidol
Molecular formula	C20H33NOSi
IUPAC name	cyclohexyl-hydroxy-phenyl-(3-piperidin-1-ylpropyl)silane
Molecular weight	331.575
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	None
Synonyms	cyclohexyl(phenyl)[3-(piperidin-1-yl)propyl]silanol hexahydrosiladiphenidol PDSP1_000646 AC1Q59YI D07LDP L000721 STK549888 C20H33NOSi CTK5H9810 Hexahydro-sila-diphenidol MolPort-002-586-096 98299-40-2 cyclohexyl-hydroxy-phenyl-(3-piperidin-1-ylpropyl)silane Hhsi-difenidol PDSP2_000641 AKOS001683522 GNF-Pf-5565 LS-178373 ZINC169857732 CAS_98299-40-2 cyclohexyl(phenyl)(3-piperidin-1-ylpropyl)silanol NSC_3602 AC1L1GAQ cyclohexylphenyl(3-piperidino-propyl)silanol HHSiD Silanol, cyclohexylphenyl(3-(1-piperidinyl)propyl)- BDBM81799 CHEMBL3545990 GTPL310 MCULE-7618291320 [ Show all ]
Inchi Key	QTBCATBNRIYMPB-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H33NOSi/c22-23(19-11-4-1-5-12-19,20-13-6-2-7-14-20)18-10-17-21-15-8-3-9-16-21/h1,4-5,11-12,20,22H,2-3,6-10,13-18H2
PubChem CID	3602
ChEMBL	N/A
IUPHAR	310
BindingDB	81799
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	Partition coefficient log P of this ligand is not available.

Experimental Data

Parameter	Value	Reference	Database source
Ki	14.0 nM	PMID1704434	PDSP,BindingDB
Ki	19.9526 nM	PMID8759038	IUPHAR
Ki	48.0 nM	PMID2385234	PDSP,BindingDB

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