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GLASS

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GPCR

Name	Mu-type opioid receptor
Species	Homo sapiens (Human)
Gene	OPRM1
Synonym	hMOP M-OR-1 MOP opioid receptor, mu 1 opioid receptor MOPr MOR-1 Mu opiate receptor Mu opioid receptor mu receptor OP3 [ Show all ]
Disease	Diarrhea Inflammatory disease Pain Major depressive disorder Migraine Mild pain Moderate-to-severe acute pain Opioid-induced constipation Opiate dependence Urinary incontinence Movement disorder Obesity Non-small cell lung cancer Systemic pain Headache Analgesia Anesthesia Asthma Cancer pain Chronic pain Constipation Diabetic neuropathy Unspecified Gastrointestinal disease Gastrointestinal disease; Pain General anesthesia Narcotic depression [ Show all ]
Length	400
Amino acid sequence	MDSSAAPTNASNCTDALAYSSCSPAPSPGSWVNLSHLDGNLSDPCGPNRTDLGGRDSLCPPTGSPSMITAITIMALYSIVCVVGLFGNFLVMYVIVRYTKMKTATNIYIFNLALADALATSTLPFQSVNYLMGTWPFGTILCKIVISIDYYNMFTSIFTLCTMSVDRYIAVCHPVKALDFRTPRNAKIINVCNWILSSAIGLPVMFMATTKYRQGSIDCTLTFSHPTWYWENLLKICVFIFAFIMPVLIITVCYGLMILRLKSVRMLSGSKEKDRNLRRITRMVLVVVAVFIVCWTPIHIYVIIKALVTIPETTFQTVSWHFCIALGYTNSCLNPVLYAFLDENFKRCFREFCIPTSSNIEQQNSTRIRQNTRDHPSTANTVDRTNHQLENLEAETAPLP
UniProt	P35372
Protein Data Bank	N/A
GPCR-HGmod model	P35372
3D structure model	This predicted structure model is from GPCR-EXP P35372.
BioLiP	N/A
Therapeutic Target Database	T47768
ChEMBL	CHEMBL233
IUPHAR	319
DrugBank	BE0000770

Ligand

Name	MLS000733666
Molecular formula	C25H29NO3
IUPAC name	[1-[[2-(furan-2-yl)phenyl]methyl]-3-[(3-methoxyphenyl)methyl]piperidin-3-yl]methanol
Molecular weight	391.511
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	4.3
Synonyms	[1-[[2-(2-furanyl)phenyl]methyl]-3-[(3-methoxyphenyl)methyl]-3-piperidinyl]methanol cid_16191320 [1-[2-(2-furyl)benzyl]-3-(3-methoxybenzyl)piperidin-3-yl]methanol [1-[[2-(furan-2-yl)phenyl]methyl]-3-[(3-methoxyphenyl)methyl]piperidin-3-yl]methanol HMS2597M24 MolPort-005-093-977 [1-[2-(2-furyl)benzyl]-3-m-anisyl-3-piperidyl]methanol CHEMBL1582232 HMS3383F03 SMR000317630 BDBM83354 [ Show all ]
Inchi Key	BIYPQECYHGGIJC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H29NO3/c1-28-22-9-4-7-20(15-22)16-25(19-27)12-6-13-26(18-25)17-21-8-2-3-10-23(21)24-11-5-14-29-24/h2-5,7-11,14-15,27H,6,12-13,16-19H2,1H3
PubChem CID	16191320
ChEMBL	CHEMBL1582232
IUPHAR	N/A
BindingDB	83354
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	<92456.0 nM	PubChem BioAssay data set	ChEMBL

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