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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	2-{4-[4-(Furan-2-carbonyl)-piperazin-1-yl]-butyl}-isoindole-1,3-dione
Molecular formula	C21H23N3O4
IUPAC name	2-[4-[4-(furan-2-carbonyl)piperazin-1-yl]butyl]isoindole-1,3-dione
Molecular weight	381.432
Hydrogen bond acceptor	5
Hydrogen bond donor	0
XlogP	2.0
Synonyms	HMS2492O24 REGID_for_CID_646155 AC1LDD1H 2-[4-[4-(furan-2-carbonyl)piperazin-1-yl]butyl]isoindole-1,3-dione MLS000030130 SMR000008086 AKOS000794843 CHEMBL1324852 MLS001385330 ZINC4967375 ASN 07610692 [ Show all ]
Inchi Key	IDNJGJKFUHTLFV-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H23N3O4/c25-19-16-6-1-2-7-17(16)20(26)24(19)10-4-3-9-22-11-13-23(14-12-22)21(27)18-8-5-15-28-18/h1-2,5-8,15H,3-4,9-14H2
PubChem CID	646155
ChEMBL	CHEMBL1324852
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	92464.0 nM	PubChem BioAssay data set	ChEMBL

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