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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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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	AC1N9R7M
Molecular formula	C22H31N5O3S
IUPAC name	N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
Molecular weight	445.582
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	2.3
Synonyms	AKOS034149618 N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-[4-(pyridin-2-yl)piperazin-1-yl]acetamide HMS2696K10 SR-01000723474-2 AB00591232-02 MolPort-004-271-369 SMR000368953 MCULE-5602582059 Z30996409 N-[3-(diethylsulfamoyl)-4-methylphenyl]-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide CHEMBL1458139 SR-01000723474 746618-44-0 MLS001002420 ZINC12528995 [ Show all ]
Inchi Key	FZHCFMLCAKHYAE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H31N5O3S/c1-4-27(5-2)31(29,30)20-16-19(10-9-18(20)3)24-22(28)17-25-12-14-26(15-13-25)21-8-6-7-11-23-21/h6-11,16H,4-5,12-15,17H2,1-3H3,(H,24,28)
PubChem CID	4365190
ChEMBL	CHEMBL1458139
IUPHAR	N/A
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
EC50	92451.0 nM	PubChem BioAssay data set	ChEMBL

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