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GPCR

Name	Beta-1 adrenergic receptor
Species	Homo sapiens (Human)
Gene	ADRB1
Synonym	Adrenergic receptor beta 1 Adrb-1 ADRB1R adrenergic receptor beta 1-AR beta1-adrenoceptor beta-1 adrenoreceptor Beta-1 adrenoceptor B1AR beta-1 adrenergic receptor [ Show all ]
Disease	Heart failure; Cardiogenic shock Heart failure Glaucoma Diabetes Coronary artery disease Circulatory disorders Chronic open-angle glaucoma; Ocular hypertension Chronic open-angle glaucoma High blood pressure High blood pressure; Angina Hypertension Septic shock; Neurogenic shock Open-angle glaucoma; Ocular hypertension Migraine Maintenance of normal sinus rhythm Hypertension; Ventricular premature beats Hypertension; Heart arrhythmia Hypertension; Angina pectoris Hypertension; Angina Ventricular fibrillation Central and peripheral nervous diseases Acute supraventricular tachycardia Open-angle glaucoma Allergy; Sepsis Angina pectoris Angina pectoris; Hypertension Bronchodilator Cardiac arrhythmias [ Show all ]
Length	477
Amino acid sequence	MGAGVLVLGASEPGNLSSAAPLPDGAATAARLLVPASPPASLLPPASESPEPLSQQWTAGMGLLMALIVLLIVAGNVLVIVAIAKTPRLQTLTNLFIMSLASADLVMGLLVVPFGATIVVWGRWEYGSFFCELWTSVDVLCVTASIETLCVIALDRYLAITSPFRYQSLLTRARARGLVCTVWAISALVSFLPILMHWWRAESDEARRCYNDPKCCDFVTNRAYAIASSVVSFYVPLCIMAFVYLRVFREAQKQVKKIDSCERRFLGGPARPPSPSPSPVPAPAPPPGPPRPAAAAATAPLANGRAGKRRPSRLVALREQKALKTLGIIMGVFTLCWLPFFLANVVKAFHRELVPDRLFVFFNWLGYANSAFNPIIYCRSPDFRKAFQRLLCCARRAARRRHATHGDRPRASGCLARPGPPPSPGAASDDDDDDVVGATPPARLLEPWAGCNGGAAADSDSSLDEPCRPGFASESKV
UniProt	P08588
Protein Data Bank	N/A
GPCR-HGmod model	P08588
3D structure model	This predicted structure model is from GPCR-EXP P08588.
BioLiP	N/A
Therapeutic Target Database	T44068
ChEMBL	CHEMBL213
IUPHAR	28
DrugBank	BE0000172

Ligand

Name	LEVISOPRENALINE
Molecular formula	C11H17NO3
IUPAC name	4-[(1R)-1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol
Molecular weight	211.261
Hydrogen bond acceptor	4
Hydrogen bond donor	4
XlogP	-0.6
Synonyms	Benzyl alcohol, 3,4-dihydroxy-alpha-((isopropylamino)methyl)-, (-)- L-Isopropylnorepinephrine Levisoprenalinum [INN-Latin] NCGC00016665-01 SCHEMBL250806 (-)-Isoproterenol 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)ethyl)-, (R)- 5FW BSPBio_001174 Isopropyl norepinephrine Levisoprenalina Lopac-I-6504 NCGC00025274-01 UNII-L628TT009W component JWZZKOKVBUJMES-NSHDSACASA-N (R)-(-)-Isoproterenol 4-[(1R)-1-hydroxy-2-(isopropylamino)ethyl]benzene-1,2-diol AC1Q1Q9S BDBM50407517 CCG-204758 l-Isoprenaline Levisoprenaline [INN:DCF] NCGC00015558-02 Prestwick3_001097 (-)-alpha-(Isopropylaminomethyl)protocatechuyl alcohol (R)-Isoproterenol 51-31-0 BPBio1_001292 CHEMBL1160723 l-Isoproterenol Levoisoproterenol NCGC00016665-03 Tocris-1747 (-)-Isoproterenol hydrochloride 110537-43-4 AB00514693 C11703 Isoproterenol, L- Levisoprenalina [INN-Spanish] Lopac0_000672 PDSP1_001116 ZINC56652 (R)-(-)-Isoproterenol, crystalline 4-[(1R)-1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol AC1Q1Q9T Benzyl alcohol, 3,4-dihydroxy-alpha-((isopropylamin)methyl)-, (-)- CHEBI:6257 l-Isopropylnoradrenaline Levisoprenalinum NCGC00015558-03 Proternol L (-)-Isoprenaline 1,2-Benzenediol, 4-((1R)-1-hydroxy-2-((1-methylethyl)amino)ethyl)- 588N0603CT BRN 3203136 DTXSID2043878 Levisoprenalin Lopac-I-5627 NCGC00016665-04 UNII-588N0603CT (-)-N-Isopropylnoradrenaline 137-95-1 AC1L9EJH ACM51310 CAS-5984-95-2 L-(-)-Isoproterenol NCGC00015558-01 PDSP2_001100 (R)-Isoprenaline [ Show all ]
Inchi Key	JWZZKOKVBUJMES-NSHDSACASA-N
Inchi ID	InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8/h3-5,7,11-15H,6H2,1-2H3/t11-/m0/s1
PubChem CID	443372
ChEMBL	CHEMBL1160723
IUPHAR	N/A
BindingDB	50407517
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	7.943 nM	PMID24359185	ChEMBL

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