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GLASS

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GPCR

Name	Beta-3 adrenergic receptor
Species	Homo sapiens (Human)
Gene	ADRB3
Synonym	ADRB Adrb-3 adrenergic receptor atypical beta-adrenoceptor beta 3-AR Beta-3 adrenoceptor Beta-3 adrenoreceptor beta3-adrenergic receptor beta3-adrenoceptor [ Show all ]
Disease	Urinary incontinence Diabetes Glaucoma Hypertension Irritable bowel syndrome Major depressive disorder; Obesity; Type 2 diabetes Major depressive disorder; Severe mood disorders Obesity Gastrointestinal disease Obesity; Type 2 diabetes Asthma; Chronic obstructive pulmonary disease Asthma Angina pectoris Overactive bladder disorder Type 2 diabetes [ Show all ]
Length	408
Amino acid sequence	MAPWPHENSSLAPWPDLPTLAPNTANTSGLPGVPWEAALAGALLALAVLATVGGNLLVIVAIAWTPRLQTMTNVFVTSLAAADLVMGLLVVPPAATLALTGHWPLGATGCELWTSVDVLCVTASIETLCALAVDRYLAVTNPLRYGALVTKRCARTAVVLVWVVSAAVSFAPIMSQWWRVGADAEAQRCHSNPRCCAFASNMPYVLLSSSVSFYLPLLVMLFVYARVFVVATRQLRLLRGELGRFPPEESPPAPSRSLAPAPVGTCAPPEGVPACGRRPARLLPLREHRALCTLGLIMGTFTLCWLPFFLANVLRALGGPSLVPGPAFLALNWLGYANSAFNPLIYCRSPDFRSAFRRLLCRCGRRLPPEPCAAARPALFPSGVPAARSSPAQPRLCQRLDGASWGVS
UniProt	P13945
Protein Data Bank	N/A
GPCR-HGmod model	P13945
3D structure model	This predicted structure model is from GPCR-EXP P13945.
BioLiP	N/A
Therapeutic Target Database	T51408
ChEMBL	CHEMBL246
IUPHAR	30
DrugBank	BE0001012, BE0004872

Ligand

Name	CHEMBL429396
Molecular formula	C20H23ClN2O2
IUPAC name	1-(3-chlorophenyl)-2-[1-(6-methoxy-1H-indol-3-yl)propan-2-ylamino]ethanol
Molecular weight	358.866
Hydrogen bond acceptor	3
Hydrogen bond donor	3
XlogP	3.8
Synonyms	BDBM50126075 1-(3-Chloro-phenyl)-2-[2-(6-methoxy-1H-indol-3-yl)-1-methyl-ethylamino]-ethanol
Inchi Key	AIYBKTHGVJGOBK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H23ClN2O2/c1-13(22-12-20(24)14-4-3-5-16(21)9-14)8-15-11-23-19-10-17(25-2)6-7-18(15)19/h3-7,9-11,13,20,22-24H,8,12H2,1-2H3
PubChem CID	11222097
ChEMBL	CHEMBL429396
IUPHAR	N/A
BindingDB	50126075
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	22.0 nM	PMID12657269	BindingDB,ChEMBL
Intrinsic activity	102.0 %	PMID12657269	ChEMBL

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