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GPCR

Name	Mu-type opioid receptor
Species	Mus musculus (Mouse)
Gene	Oprm1
Synonym	opioid receptor, mu 1 opioid receptor OP3 Mu receptor MOR-1 MOPr MOP M-OR-1 [ Show all ]
Disease	N/A for non-human GPCRs
Length	398
Amino acid sequence	MDSSAGPGNISDCSDPLAPASCSPAPGSWLNLSHVDGNQSDPCGPNRTGLGGSHSLCPQTGSPSMVTAITIMALYSIVCVVGLFGNFLVMYVIVRYTKMKTATNIYIFNLALADALATSTLPFQSVNYLMGTWPFGNILCKIVISIDYYNMFTSIFTLCTMSVDRYIAVCHPVKALDFRTPRNAKIVNVCNWILSSAIGLPVMFMATTKYRQGSIDCTLTFSHPTWYWENLLKICVFIFAFIMPVLIITVCYGLMILRLKSVRMLSGSKEKDRNLRRITRMVLVVVAVFIVCWTPIHIYVIIKALITIPETTFQTVSWHFCIALGYTNSCLNPVLYAFLDENFKRCFREFCIPTSSTIEQQNSARIRQNTREHPSTANTVDRTNHQLENLEAETAPLP
UniProt	P42866
Protein Data Bank	4dkl, 5c1m, 6dde, 6ddf
GPCR-HGmod model	N/A
3D structure model	This structure is from PDB ID 4dkl.
BioLiP	BL0416752, BL0416751, BL0321492, BL0224753, BL0224754, BL0224755,BL0224756, BL0321491
Therapeutic Target Database	N/A
ChEMBL	CHEMBL2858
IUPHAR	319
DrugBank	N/A

Ligand

Name	naloxone
Molecular formula	C19H21NO4
IUPAC name	(4R,4aS,7aR,12bS)-4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one
Molecular weight	327.38
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	2.1
Synonyms	NCGC00274058-01 BRD-K67511046-003-03-7 PDSP2_001520 cid_5464092 SPBio_002061 DSSTox_CID_3349 [N-allyl-2,3-3H]naloxone GTPL1676 LS-92141 (4R,4aS,7aR,12bS)-3-allyl-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5alpha)- 1-N-Allyl-14-hydroxynordihydromorphinone N-Allyl-4,5alpha-epoxy-3,14-dihydroxy-6-morphinanon 17-Allyl-4,5alpha-epoxy-3,14-dihydroxymorphinan-6-one Naloxona [INN-Spanish] 4-allyl-10,17-dihydroxy-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-14-one Narcan AKOS016009988 BDBM50000788 NSC 70413 C07252 Prestwick2_000111 D0X3FX UNII-36B82AMQ7N DTXSID8023349 KB-297992 MLS000736771 (5alpha)-3,14-dihydroxy-17-prop-2-en-1-yl-4,5-epoxymorphinan-6-one Morphinan-6-one, 4,5alpha-epoxy-3,14-dihydroxy-17-(2-propenyl)- 12-Allyl-7,7a,8,9-tetrahydro-3,7a-dihydroxy-4aH-8,9c-iminoethanophenanthro[4,5-bcd]furan-5(6H)-one Nalone 36B82AMQ7N Naloxone Nasal Spray 465N656 Narcanti (TN) NCGC00024674-03 BPBio1_000136 Nyxoid SMP1_000205 DBL Naloxone [17-(2,3-3H-2-propenyl)]-4, 5a -epoxy-3,14-dihydroxymorphinan-6-one EN 1530base l-Naloxone (1S,5R,13R,17S)-10,17-dihydroxy-4-(prop-2-en-1-yl)-12-oxa-4-azapentacyclo[9.6.1.0;{1,13}.0;{5,17}.0;{7,18}]octadeca-7(18),8,10-trien-14-one Morphinan-6-one, 17-allyl-4,5alpha-epoxy-3,14-dihydroxy-(8CI) (naloxone)4-allyl-10,17-dihydroxy-(1S,5R,13R,17S)-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-14-one Morphinan-6-one,5.alpha.-epoxy-3,14-dihydroxy- 17-allyl-3,14-dihydroxy-4,5alpha-epoxymorphinan-6-one Nalossone [DCIT] 4-allyl-10,17-dihydroxy-(1S,5R,13R,17S)-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-14-one( Naloxone) Naloxonum AN-45114 Normorphinone, N-allyl-7,8-dihydro-14-hydroxy-, (-)- BRN 1089071 Prestwick0_000111 D08249 Tox21_112006 DSSTox_GSID_23349 HMS2090F20 MCULE-1335589007 (4R,4aS,7aR,12bS)-4a,9-bis(oxidanyl)-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5alpha)- (9CI) 1-N-Allyl-7,8-dihydro-14-hydroxynormorphinone N-Allyl-noroxymorphone 3,14-dihydroxy-17-(prop-2-en-1-yl)-4,5alpha-epoxymorphinan-6-one 4-allyl-10,17-dihydroxy-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-14-one(naloxone)C2H2O4 Narcan (TN) BDBM54795 NSC-70413 CAS-465-65-6 Prestwick3_000111 UZHSEJADLWPNLE-GRGSLBFTSA-N EINECS 207-365-7 l-N-Allyl-14-hydroxynordihydromorphinone (-)-N-allyl-14-hydroxynordihydroxymorphinan-6-one Morphinan-6-one, 17-allyl-4,5alpha-epoxy-3,14-dihydroxy- (5alpha)-4,5-Epoxy-3,14-dihydroxy-17-(2-propenyl)morphinan-6-one Morphinan-6-one,4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-,(5\|A)- Nalone (TN) 4-allyl-10,17-dihydroxy-(1S,5R,13R,17S)-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-14-one Naloxone solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material 4aH-8,5-bcd]furan-5(6H)-one, N-allyl-7,7a,8,9-tetrahydro-3,7a-dihydroxy- Narcon NCGC00162267-02 BRD-K67511046-001-02-3 O940 CHEMBL80 SMR000058766 DBL Naloxone (TN) [3H]naloxone GTPL1638 LS-187184 (1S,5R,13R,17S)-10,17-dihydroxy-4-(prop-2-en-1-yl)-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10-trien-14-one Morphinan-6-one, 4,5-alpha-epoxy-3,14-dihydroxy-17-(2-propenyl)- (naloxone)4-allyl-10,17-dihydroxy-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-14-one Morphinan-6-one,5.alpha.-epoxy-3,14-dihydroxy-17-(2-propenyl)- 17-Allyl-4,5-alpha-epoxy-3,14-dihydroxymorphinan-6-one Naloxona 4-allyl-10,17-dihydroxy-(1S,5R,13R,17S)-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-14-one(Naxolone) Naloxonum [INN-Latin] AJ-20933 API0003490 Normorphinone, N-allyl-dihydro-14-hydroxy- BSPBio_000122 Prestwick1_000111 D0RN5A Tox21_112006_1 DSSTox_RID_76986 HSDB 3279 MLS000069540 (4R,4aS,7aR,12bS)-4a,9-dihydroxy-3-prop-2-enyl-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride Morphinan-6-one, 4,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5alpha)-(9CI) 12-Allyl-7,7a,8,9-tetrahydro-3,7a-dihydroxy-4aH-8,9c-iminoethanophenanthro(4,5-bcd)furanone n-Allylnoroxymorphone 357-08-4 (hydrochloride) Naloxone (INN) 465-65-6 Narcanti NCGC00024674-02 BIDD:GT0110 NSC70413 CHEBI:7459 SCHEMBL34284 DB01183 ZINC389747 EN 1530 base l-N-Allyl-7,8-dihydro-14-hydroxynormorphinone (-)-Naloxone Morphinan-6-one, 17-allyl-4,5alpha-epoxy-3,14-dihydroxy- (8CI) (naloxone) 4-allyl-10,17-dihydroxy-(1S,5R,13R,17S)-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-14-one Morphinan-6-one,5-epoxy-3,14-dihydroxy-17-(2-propenyl)-, (5.alpha.)- Nalossone 4-allyl-10,17-dihydroxy-(1S,5R,13R,17S)-12-oxa-4-azapentacyclo[9.6.1.01,13.05,17.07,18]octadeca-7(18),8,10-trien-14-one (naloxone) Naloxone [INN:BAN] [ Show all ]
Inchi Key	UZHSEJADLWPNLE-GRGSLBFTSA-N
Inchi ID	InChI=1S/C19H21NO4/c1-2-8-20-9-7-18-15-11-3-4-12(21)16(15)24-17(18)13(22)5-6-19(18,23)14(20)10-11/h2-4,14,17,21,23H,1,5-10H2/t14-,17+,18+,19-/m1/s1
PubChem CID	5284596
ChEMBL	CHEMBL80
IUPHAR	1638, 1676
BindingDB	54795, 50000788
DrugBank	DB01183
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
AD50	0.08 mg kg-1	PMID8410998, PMID8410999	ChEMBL
Kd	1.0 nM	PMID8114680	IUPHAR
Kd	10.23 nM	PMID17962026	ChEMBL
Ke	1.4 nM	PMID7636870, PMID2536439, PMID2157011	ChEMBL
Ki	0.31 nM	PMID9694962	BindingDB
Ki	0.67 nM	PMID9694962	BindingDB
Ki	1.0 nM	PMID8114680	IUPHAR

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