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GPCR

Name	Kappa-type opioid receptor
Species	Homo sapiens (Human)
Gene	OPRK1
Synonym	K-OR-1 KOPr OP2 KOP KOR-1 Kappa receptor [ Show all ]
Disease	Obesity Opiate dependence Inflammatory bowel disease Erythema Diarrhea-predominant IBS Unspecified Bipolar disorder Alcohol use disorders Pain Substance dependence Neurodegenerative disease [ Show all ]
Length	380
Amino acid sequence	MDSPIQIFRGEPGPTCAPSACLPPNSSAWFPGWAEPDSNGSAGSEDAQLEPAHISPAIPVIITAVYSVVFVVGLVGNSLVMFVIIRYTKMKTATNIYIFNLALADALVTTTMPFQSTVYLMNSWPFGDVLCKIVISIDYYNMFTSIFTLTMMSVDRYIAVCHPVKALDFRTPLKAKIINICIWLLSSSVGISAIVLGGTKVREDVDVIECSLQFPDDDYSWWDLFMKICVFIFAFVIPVLIIIVCYTLMILRLKSVRLLSGSREKDRNLRRITRLVLVVVAVFVVCWTPIHIFILVEALGSTSHSTAALSSYYFCIALGYTNSSLNPILYAFLDENFKRCFRDFCFPLKMRMERQSTSRVRNTVQDPAYLRDIDGMNKPV
UniProt	P41145
Protein Data Bank	6b73, 4djh
GPCR-HGmod model	P41145
3D structure model	This structure is from PDB ID 6b73.
BioLiP	BL0402244,BL0402246, BL0224693,BL0224694, BL0402243,BL0402245
Therapeutic Target Database	T60693
ChEMBL	CHEMBL237
IUPHAR	318
DrugBank	BE0000632

Ligand

Name	HYDROCODONE
Molecular formula	C18H21NO3
IUPAC name	(4R,4aR,7aR,12bS)-9-methoxy-3-methyl-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-one
Molecular weight	299.37
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	2.2
Synonyms	Novahistex (TN) BRN 0094193 Symtan (TN) D0C2DS Dihydrocodeinone Hycet (TN) Hydrocodone 1.0 mg/ml in Methanol Hydrocodone [INN:BAN] Idrocodone (1S,5R,13R,17R)-10-methoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0;{1,13}.0;{5,17}.0;{7,18}]octadeca-7(18),8,10-trien-14-one LS-92156 34195-34-1 (tartrate (1:1), hydrate (2:5)) Morphinan-6-one, 4,5alpha-epoxy-3-methoxy-17-methyl-(8CI) 50678-79-0 NSC19044 WLN: T B6566 B6/CO 4ABBC R BX FV HO PN GHT&&TTJ JO1 P1 DB00956 EINECS 204-733-9 Hydrocodeinonebitartrate Hydrocodone prodrug (Bio-MD, pain), PharmacoFore Hydrocon KP-201 1037-91-8 Morphinan-6-one, 4,5-epoxy-3-methoxy-17-methyl-, (5alpha)- 4,5alpha-epoxy-3-methoxy-17-methyl-morphinan-6-one Multacodin Norco (TN) BDBM50386689 PF-06 program Codinovo Dicodid Hidrocodona [INN-Spanish] Hydrocodone (INN) Hydrocodone prodrug (Bio-MD/MPAR/oral/immediate release, pain), PharmacoFore Hydrokon (TN) Lorcet (TN) 17-methyl-4,5alpha-epoxy-3-methoxymorphinan-6-one Morphinan-6-one, 4,5alpha-epoxy-3-methoxy-17-methyl- 4aH-8,5-bcd]furan-5-(6H)-one, 7,7a,8,9-tetrahydro-3-methoxy-12-methyl- NSC 19044 C08024 Synkonin (TN) D0X5KF DTXSID8023131 Hycodan (TN) Hydrocodone polistirex Hydrocodonum Idrocodone [DCIT] (4R,4aR,7aR,12bS)-9-methoxy-3-methyl-1,2,4,4a,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one Mercodinone (TN) 4,5-alpha-Epoxy-3-methoxy-17-methylmorphinan-6-one Morphinan-6-one,5-epoxy-3-methoxy-17-methyl-, (5.alpha.)- 6-Oxo-3-methoxy-N-methyl-4,5-epoxymorphinan 9007-52-7 opioid1 CHEMBL1457 ZINC1280665 DEA No. 9193 GTPL7081 Hydrocodon Hydrocodone prodrug (Bio-MD/immediate release, pain), PharmacoFore Hydrocone KP-201 hydrocodone prodrug 125-29-1 Morphinan-6-one, 4,5-epoxy-3-methoxy-17-methyl-, (5alpha)- (9CI) 4,5alpha-Epoxy-3-methoxy-17-methylmorphinan-6-one NCGC00159317-02 Norgan (TN) Bekadid SCHEMBL2987 D08045 Dicodid (TN) HSDB 3097 Hydrocodone 0.1 mg/ml in Methanol Hydrocodone prodrug (oral, pain), KemPharm Hydrovo (TN) (-)-Dihydrocodeinone Lortab (TN) 3-methoxy-17-methyl-4,5alpha-epoxymorphinan-6-one Morphinan-6-one, 4,5alpha-epoxy-3-methoxy-17-methyl- (8CI) NSC-19044 CHEBI:5779 UNII-6YKS4Y3WQ7 Duodin (TN) Hycomine (TN) Hydrocodone polistirex [USAN] Hydrocodonum [INN-Latin] Kolikodol (TN) (5alpha)-17-methyl-3-(methyloxy)-4,5-epoxymorphinan-6-one Morphinan-6-one, 4,5-alpha-epoxy-3-methoxy-17-methyl- 4,5.alpha.-Epoxy-3-methoxy-17-methylmorphinan-6-one Morphinan-6-one,5.alpha.-epoxy-3-methoxy-17-methyl- 6YKS4Y3WQ7 Anexsia (TN) Orthoxycol (TN) Codeinone, dihydro- Zohydro DICO hidrocodona Hydrocodone prodrug (Bio-MD/MPAR/oral, pain), PharmacoFore Hydroconum LLPOLZWFYMWNKH-CMKMFDCUSA-N 1469752-80-4 Morphinan-6-one, 4,5-epoxy-3-methoxy-17-methyl-, (5alpha)-(9CI) 4-27-00-03580 (Beilstein Handbook Reference) NCGC00159317-03 [ Show all ]
Inchi Key	LLPOLZWFYMWNKH-CMKMFDCUSA-N
Inchi ID	InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3,6,11-12,17H,4-5,7-9H2,1-2H3/t11-,12+,17-,18-/m0/s1
PubChem CID	5284569
ChEMBL	CHEMBL1457
IUPHAR	7081
BindingDB	50386689
DrugBank	DB00956
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	260.0 nM	PMID22439881	BindingDB,IUPHAR,ChEMBL

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