acompound

Showing entry for Levallorphan

General Compound Information
BXGC Id	BXGC0015808
Compound Name	Levallorphan
Structure
Formula	C19H25NO
InchiKey	OZYUPQUCAUTOBP-QXAKKESOSA-N
SMILES	C=CCN1CC[C@@]23[C@H]([C@H]1Cc1c3cc(cc1)O)CCCC2
Inchi	InChI=1S/C19H25NO/c1-2-10-20-11-9-19-8-4-3-5-16(19)18(20)12-14-6-7-15(21)13-17(14)19/h2,6-7,13,16,18,21H,1,3-5,8-12H2/t16-,18+,19+/m0/s1
IUPAC
Molecular Weight	283.19
Pubchem Id	5359371
Chembl Id	CHEMBL1254682

Targets of Information Source

DrugBank

DB00504

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
P35372	BXGT009823	Mu-type opioid receptor	reviewed	G-protein coupled receptor	OPRM1	approved	partial agonist

PDB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1

Binding DB

50326673

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
reviewed	BXGT009823	Mu-type opioid receptor	reviewed	G-protein coupled receptor	OPRM1	1.7	-	-	-
reviewed	BXGT009823	Mu-type opioid receptor	reviewed	G-protein coupled receptor	OPRM1	0.48	-	-	-
reviewed	BXGT009731	Mu-type opioid receptor	reviewed		Oprm1	-	0.54	-	-
reviewed	BXGT009731	Mu-type opioid receptor	reviewed		Oprm1	-	1.1	-	-
reviewed	BXGT009731	Mu-type opioid receptor	reviewed		Oprm1	-	0.6341	-	-
reviewed	BXGT004559	Acetylcholinesterase	reviewed		ache	12000	-	-	-
reviewed	BXGT009823	Mu-type opioid receptor	reviewed	G-protein coupled receptor	OPRM1	1.3	-	-	-

CHEMBL

CHEMBL1254682

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units
P33535	BXGT009731	Mu-type opioid receptor	reviewed	-	Oprm1	IC50	'='	0	nM
P34975	BXGT009780	Kappa-type opioid receptor	reviewed	-	Oprk1	IC50	'='	0	nM
P33533	BXGT009729	Delta-type opioid receptor	reviewed	-	Oprd1	IC50	'='	0	nM
O42275	BXGT004559	Acetylcholinesterase	reviewed	-	ache	Ki	'='	12000	nM
P35372	BXGT009823	Mu-type opioid receptor	reviewed	G-protein coupled receptor	OPRM1	IC50	'='	2	nM
P41145	BXGT010225	Kappa-type opioid receptor	reviewed	G-protein coupled receptor	OPRK1	IC50	'='	2	nM
P35372	BXGT009823	Mu-type opioid receptor	reviewed	G-protein coupled receptor	OPRM1	Ratio	'='	2	-
P41143	BXGT010223	Delta-type opioid receptor	reviewed	G-protein coupled receptor	OPRD1	Ratio	'='	2	-
P41145	BXGT010225	Kappa-type opioid receptor	reviewed	G-protein coupled receptor	OPRK1	Ratio	'='	2	-
P35372	BXGT009823	Mu-type opioid receptor	reviewed	G-protein coupled receptor	OPRM1	IC50	'='	0	nM
P41145	BXGT010225	Kappa-type opioid receptor	reviewed	G-protein coupled receptor	OPRK1	IC50	'='	0	nM
P33535	BXGT009731	Mu-type opioid receptor	reviewed	-	Oprm1	IC50	'='	1	nM
P34975	BXGT009780	Kappa-type opioid receptor	reviewed	-	Oprk1	IC50	'='	1	nM
P33533	BXGT009729	Delta-type opioid receptor	reviewed	-	Oprd1	IC50	'='	1	nM
Q9NUW8	BXGT021219	Tyrosyl-DNA phosphodiesterase 1	reviewed	Enzyme	TDP1	Potency	-	4731	nM
P35372	BXGT009823	Mu-type opioid receptor	reviewed	G-protein coupled receptor	OPRM1	Ki	'='	1	nM
P35372	BXGT009823	Mu-type opioid receptor	reviewed	G-protein coupled receptor	OPRM1	Ki	'='	1	nM
P33535	BXGT009731	Mu-type opioid receptor	reviewed	-	Oprm1	IC50	'='	0	nM
P35372	BXGT009823	Mu-type opioid receptor	reviewed	G-protein coupled receptor	OPRM1	Ki	'='	0	nM

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF00402	Opium poppy	Papaver somniferum	Herbs and Spices

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}