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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 M4
Species	Rattus norvegicus (Rat)
Gene	Chrm4
Synonym	cholinergic receptor cholinergic receptor, muscarinic 4 Chrm-4 HM3 M4 receptor
Disease	N/A for non-human GPCRs
Length	478
Amino acid sequence	MXNFTPVNGSSANQSVRLVTAAHNHLETVEMVFIATVTGSLSLVTVVGNILVMLSIKVNRQLQTVNNYFLFSLGCADLIIGAFSMNLYTLYIIKGYWPLGAVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPARRTTKMAGLMIAAAWVLSFVLWAPAILFWQFVVGKRTVPDNQCFIQFLSNPAVTFGTAIAAFYLPVVIMTVLYIHISLASRSRVHKHRPEGPKEKKAKTLAFLKSPLMKPSIKKPPPGGASREELRNGKLEEAPPPALPPPPRPVPDKDTSNESSSGSATQNTKERPPTELSTAEATTPALPAPTLQPRTLNPASKWSKIQIVTKQTGNECVTAIEIVPATPAGMRPAANVARKFASIARNQVRKKRQMAARERKVTRTIFAILLAFILTWTPYNVMVLVNTFCQSCIPERVWSIGYWLCYVNSTINPACYALCNATFKKTFRHLLLCQYRNIGTAR
UniProt	P08485
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	CHEMBL317
IUPHAR	16
DrugBank	N/A

Ligand

Name	4-(2-Aminoethyl)-2-methoxyphenol
Molecular formula	C9H13NO2
IUPAC name	4-(2-aminoethyl)-2-methoxyphenol
Molecular weight	167.208
Hydrogen bond acceptor	3
Hydrogen bond donor	2
XlogP	0.2
Synonyms	Lopac-M-4251 NCGC00162257-01 SC-23404 0F899116-F44F-422B-B36A-7F12600FCCBD ZINC119675 3-O-methyldopamine 5-(2-aminoethyl)guaiacol AC1Q4FDS bmse000929 EC 611-267-3 MolPort-001-787-378 Phenol,5-(2-aminoethyl)-2-methoxy- ST50308633 2-(4-hydroxy-3-methoxyphenyl)-ethylamine AN-2460 C05587 CS-0028515 GTPL6642 KB-33674 NCGC00015674-02 S-6469 UNII-JCH2767EDP 3-Methoxytyramine 4-hydroxy-3-methoxyphenylethylamine AC-6711 BC652763 CCG-204880 DB-031871 Lopac0_000796 NCGC00162257-02 SCHEMBL68386 1477-68-5 (hydrochloride) 4-(2-Amino-ethyl)-2-methoxy-phenol 554-52-9 AJ-11609 bmse000958 CHEMBL1160785 EN002219 MT-3 Q-102400 TC-061232 3-Methoxy-4-hydroxyphenethylamine 4-(2-Aminoethyl)-2-methoxyphenol # A8025 AN-368 CA-1897 CTK4G8271 HY-103638A L000765 NCGC00015674-03 SBB003882 W6947 3-MT 4CH-000748 AC1L1BYX BDBM85380 CHEBI:1582 DIVQKHQLANKJQO-UHFFFAOYSA-N MCULE-3695866663 Phenol, 4-(2-aminoethyl)-2-methoxy- ST2405319 2-(4-hydroxy-3-methoxy-phenyl)-ethylamine 4-(2-aminoethyl)-2-methoxy-Phenol 554A529 AKOS000161280 BR-49905 cid_11957621 FT-0711461 JCH2767EDP NCGC00015674-01 RP23021 Tyramine, 3-methoxy- 3-Methoxy-4-hydroxyphenylethyl amine 4-hydroxy-3-methoxyphenethylamine AB0025476 ANW-47870 CAS_1477-68-5 D09ERP [ Show all ]
Inchi Key	DIVQKHQLANKJQO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C9H13NO2/c1-12-9-6-7(4-5-10)2-3-8(9)11/h2-3,6,11H,4-5,10H2,1H3
PubChem CID	1669
ChEMBL	CHEMBL1160785
IUPHAR	N/A
BindingDB	85380
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	<10000.0 nM	PMID9834968	BindingDB

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