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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 DM1
Species	Drosophila melanogaster (Fruit fly)
Gene	mAChR-A
Synonym	N/A
Disease	N/A for non-human GPCRs
Length	805
Amino acid sequence	MEPVMSLALAAHGPPSILEPLFKTVTTSTTTTTTTTTSTTTTTASPAGYSPGYPGTTLLTALFENLTSTAASGLYDPYSGMYGNQTNGTIGFETKGPRYSLASMVVMGFVAAILSTVTVAGNVMVMISFKIDKQLQTISNYFLFSLAIADFAIGAISMPLFAVTTILGYWPLGPIVCDTWLALDYLASNASVLNLLIISFDRYFSVTRPLTYRAKRTTNRAAVMIGAAWGISLLLWPPWIYSWPYIEGKRTVPKDECYIQFIETNQYITFGTALAAFYFPVTIMCFLYWRIWRETKKRQKDLPNLQAGKKDSSKRSNSSDENTVVNHASGGLLAFAQVGGNDHDTWRRPRSESSPDAESVYMTNMVIDSGYHGMHSRKSSIKSTNTIKKSYTCFGSIKEWCIAWWHSGREDSDDFAYEQEEPSDLGYATPVTIETPLQSSVSRCTSMNVMRDNYSMGGSVSGVRPPSILLSDVSPTPLPRPPLASISQLQEMSAVTASTTANVNTSGNGNGAINNNNNASHNGNGAVNGNGAGNGSGIGLGTTGNATHRDSRTLPVINRINSRSVSQDSVYTILIRLPSDGASSNAANGGGGGPGAGAAASASLSMQGDCAPSIKMIHEDGPTTTAAAAPLASAAATRRPLPSRDSEFSLPLGRRMSHAQHDARLLNAKVIPKQLGKAGGGAAGGGVGGAHALMNARNAAKKKKKSQEKRQESKAAKTLSAILLSFIITWTPYNILVLIKPLTTCSDCIPTELWDFFYALCYINSTINPMCYALCNATFRRTYVRILTCKWHTRNREGMVRGVYN
UniProt	P16395
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	CHEMBL2366467
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	Arecaidine propargyl ester
Molecular formula	C10H13NO2
IUPAC name	prop-2-ynyl 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate
Molecular weight	179.219
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	0.5
Synonyms	NCGC00015006-04 2-Propynyl 1-methyl-1,2,5,6-tetrahydro-3-pyridinecarboxylate DTXSID30274358 Lopac-A-140 prop-2-ynyl 1-methyl-3,6-dihydro-2H-pyridine-5-carboxylate 3-Pyridinecarboxylic acid, 1,2,5,6-tetrahydro-1-methyl-, 2-propynyl ester CHEBI:92418 NCGC00015006-02 SPHRJZBOFYIKMC-UHFFFAOYSA-N AC1Q62JO CTK1B6885 NCGC00162072-01 2-Propynyl 1-methyl-1,2,5,6-tetrahydro-3-pyridinecarboxylate # BRD-K23922020-075-01-1 GTPL295 Lopac0_000136 prop-2-ynyl 1-methyl-5,6-dihydro-2H-pyridine-3-carboxylate 35516-99-5 NCGC00015006-03 ZINC25720839 1-Methyl-1,2,5,6-tetrahydropyridine-3-carboxylic acid, 2-propynyl ester AKOS030566155 D0I9LU NCGC00162072-02 CCG-204231 L000114 NCGC00015006-01 SCHEMBL13184690 AC1L1D7L CHEMBL128365 [ Show all ]
Inchi Key	SPHRJZBOFYIKMC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C10H13NO2/c1-3-7-13-10(12)9-5-4-6-11(2)8-9/h1,5H,4,6-8H2,2H3
PubChem CID	2229
ChEMBL	CHEMBL128365
IUPHAR	295
BindingDB	N/A
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	4490.0 nM	PMID17319687	ChEMBL
Ki	5200.0 nM	PMID17319687	ChEMBL

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