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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	Mu-type opioid receptor
Species	Bos taurus (Bovine)
Gene	OPRM1
Synonym	M-OR-1 MOR-1
Disease	N/A for non-human GPCRs
Length	401
Amino acid sequence	MDSGAVPTNASNCTDPFTHPSSCSPAPSPSSWVNFSHLEGNLSDPCGPNRTELGGSDRLCPSAGSPSMITAIIIMALYSIVCVVGLFGNFLVMYVIVRYTKMKTATNIYIFNLALADALATSTLPFQSVNYLMGTWPFGTILCKIVISIDYYNMFTSIFTLCTMSVDRYIAVCHPVKALDLRTPRNAKIINICNWILSSAIGLPVMFMATTKYRQGSIDCTLTFSHPTWYWENLLKICVFIFAFIMPILIITVCYGLMILRLKSVRMLSGSKEKDRNLRRITRMVLVVVAVFIVCWTPIHIYVIIKALITIPETTFQTVSWHFCIALGYTNSCLNPVLYAFLDENFKRCFREFCIPTSSTIEQQNSTRIRQNTRDHPSTANTVDRTNHQLENLEAETTPLP
UniProt	P79350
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	CHEMBL3041
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL418460
Molecular formula	C16H21NO
IUPAC name	9,13-dimethyl-13-azatetracyclo[7.5.1.01,12.03,8]pentadeca-3(8),4,6-trien-6-ol
Molecular weight	243.35
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	3.0
Synonyms	9,13-dimethyl-13-azatetracyclo[7.5.1.01,12.03,8]pentadeca-3,5,7-trien-6-ol BDBM50050483
Inchi Key	HUBOTCKKRXYMHW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H21NO/c1-15-6-5-14-16(9-15,10-17(14)2)8-11-3-4-12(18)7-13(11)15/h3-4,7,14,18H,5-6,8-10H2,1-2H3
PubChem CID	44301533
ChEMBL	CHEMBL418460
IUPHAR	N/A
BindingDB	50050483
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	179.0 nM	PMID8642554	BindingDB,ChEMBL

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