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GPCR

Name	Beta-3 adrenergic receptor
Species	Rattus norvegicus (Rat)
Gene	Adrb3
Synonym	beta3-adrenoceptor beta3-adrenergic receptor Beta-3 adrenoreceptor Beta-3 adrenoceptor ADRB beta 3-AR atypical beta-adrenoceptor adrenergic receptor Adrb-3 [ Show all ]
Disease	N/A for non-human GPCRs
Length	400
Amino acid sequence	MAPWPHKNGSLAFWSDAPTLDPSAANTSGLPGVPWAAALAGALLALATVGGNLLVITAIARTPRLQTITNVFVTSLATADLVVGLLVMPPGATLALTGHWPLGATGCELWTSVDVLCVTASIETLCALAVDRYLAVTNPLRYGTLVTKRRARAAVVLVWIVSATVSFAPIMSQWWRVGADAEAQECHSNPRCCSFASNMPYALLSSSVSFYLPLLVMLFVYARVFVVAKRQRRLLRRELGRFPPEESPRSPSRSPSPATVGTPTASDGVPSCGRRPARLLPLGEHRALRTLGLIMGIFSLCWLPFFLANVLRALVGPSLVPSGVFIALNWLGYANSAFNPLIYCRSPDFRDAFRRLLCSYGGRGPEEPRVVTFPASPVASRQNSPLNRFDGYEGERPFPT
UniProt	P26255
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4031
IUPHAR	30
DrugBank	N/A

Ligand

Name	isoproterenol
Molecular formula	C11H17NO3
IUPAC name	4-[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	Spectrum_000949 Izadrin (Salt/Mix) WLN: QR BQ DYQ1MY1&1 KBioSS_001429 LS-42869 NCGC00015558-05 NCGC00015558-14 Norisodrine Oprea1_009434 Protocatechuyl alcohol,- SCHEMBL4165 Isoproterenolum CAS-7683-59-2 (.+/-.)-Isoproterenol d-Isopropylarterenol 1, 4-[1-hydroxy-2-[(1-methylethyl)amino]ethyl]- DB01064 1-(3,4-Dihydroxyphenyl)-2-(isopropylamino)ethanol DL-Isopropylnorepinephrine 3,4-dihydroxy-alpha-[(isopropylamino)methyl]benzyl alcohol Epinephrine isopropyl homolog 4-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol Isadrin 683I592 Isoprenaline (INN) AKOS015913894 Isopropyladrenaline AS1409 Isoproterenol Chloride Benzyl alcohol, 3,4-dihydroxy-alpha-((isopropylamino)methyl)- Isuprel Tox21_110172 KBio2_001429 L000936 N-Isopropyl-.beta.-dihydroxyphenyl-.beta.-hydroxyethylamine NCGC00015558-08 NCGC00025274-04 NSC 9975 Prestwick0_001097 Racemic isoproterenol SPBio_003057 Benzyl alcohol,4-dihydroxy-.alpha.-[(isopropylamino)methyl]- (+-)-Isoprenaline CCRIS 3081 (S)-Isoprenaline D08090 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)ethyl)-(9CI) DL(+-)-Isoproterenol DSSTox_GSID_23175 4-(1-Hydroxy-2-((1-methylethyl)amino)ethyl)-1,2-benzenediol GTPL536 4-{1-hydroxy-2-[(propan-2-yl)amino]ethyl}benzene-1,2-diol Isonorin AB00053487-10 Isoprenalinum alpha-(Isopropylaminomethyl)protocatechuyl alcohol Isopropylarterenol Assiprenol Isoproterenol-l Spectrum4_000024 Isuprel Mistometer Vapo-N-iso KBio3_001428 LS-42866 N-Isopropylnorepinephrine NCGC00015558-11 Neodrenal NSC33791 Proternol SBB005855 BSPBio_002208 (+/-)-isoproterenol CHEMBL434 .alpha.-(Isopropylaminomethyl)protocatechuyl alcohol D0P1IS 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)ethyl)-, (S)-(9CI) dl-Isadrine 3,4-Dihydroxy-alpha-((isopropylamino)methyl)benzyl alcohol EINECS 231-687-7 4-[1-hydroxy-2-(isopropylamino)ethyl]benzene-1,2-diol ICI 46399 Isoprenalina [INN-Spanish] AC1L1GOZ Isopropydrin Aludrine Bellasthman ISOPROTERONOL ST077771 JWZZKOKVBUJMES-UHFFFAOYSA-N l-Isopropylnoradrenaline MCULE-6061231962 NCGC00015558-06 NCGC00016665-02 Novodrin PDSP1_001425 Protocatechuyl alcohol,.alpha.-(isopropylamino-methyl),- SGCUT00015 (+)-Isoprenaline CCG-204727 (A+/-)-Isoproterenol hydrochloride d-Isoproterenol 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)ethyl)- Dihydroxyphenylethanolisopropylamine 1-(3,4-Dihydroxyphenyl)-2-isopropylaminoethanol dl-N-Isopropylnoradrenaline 3-13-00-02387 (Beilstein Handbook Reference) Euspiran (Salt/Mix) 4-{1-hydroxy-2-[(1-methylethyl)amino]ethyl}benzene-1,2-diol Isadrine 7683-59-2 Isoprenaline [INN] Aleudrin Isopropylaminomethyl(3,4-dihydroxyphenyl)carbinol Asiprenol Isoproterenol [JAN] BENZYL ALCOHOL, 3,4-DIHYDROXY-alpha-((ISOPROPYLAMINO)METHYL)-, (+)- Isuprel (Salt/Mix) Tox21_110172_1 KBio2_003997 Lomupren N-Isopropyl-beta-dihydroxyphenyl-beta-hydroxyethylamine NCGC00015558-09 NCGC00162220-01 NSC-33791 Prestwick1_001097 Respifral Spectrum2_001061 BRN 2213857 (+-)-Isoproterenol CHEBI:64317 (S)-Isoproterenol D0I8FI 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)ethyl)-, (+-)- DL(.+/-.)-Isoproterenol 3,4-Dihydroxy-.alpha.-(isopropylaminomethyl)-benzyl alcohol DSSTox_RID_76904 4-(1-Hydroxy-2-(isopropylamino)ethyl)benzene-1,2-diol HMS2089A12 4-{1-hydroxy-2-[(propan-2-yl)amino]ethyl}benzene-1,2-diol, 2 Isoprenalin AB00053487_11 Isoprenalinum [INN-Latin] alpha-(Isopropylaminomoethyl)protocatechuyl alcohol Isopropylnoradrenaline BCP09043 Spectrum5_000880 Isupren WIN 5162 KBioGR_000427 LS-42868 NCGC00015558-04 NCGC00015558-12 NINDS_000894 NSC9975 Protocatechuyl alcohol, alpha-(isopropylaminomethyl)- SBI-0050689.P004 Isoproterenol; C07056 (.+/-.)-Isoprenaline d-Isoprenaline .alpha.-(Isopropylaminomoethyl)protocatechuyl alcohol 1,2-Benzenediol, 4-[1-hydroxy-2-[(1-methylethyl)amino]ethyl]- dl-Isopropylnoradrenaline 3,4-dihydroxy-alpha-[(isopropylamino)methyl]-benzyl alcohol EN300-148243 4-[1-hydroxy-2-(isopropylamino)ethyl]pyrocatechol;hydrochloride IDI1_000894 6700-39-6 Isoprenaline AC1Q1QBS Isopropyl noradrenaline API0006523 Isoproterenol (-) Benzyl alcohol, 3,4-dihydroxy-.alpha.-((isopropylamino)methyl)- Isorenin STL558077 KBio1_000894 l-Isoproterenol Medihaler-ISO NCGC00015558-07 NCGC00025274-03 NSC 33791 PDSP2_001409 Racemic isoprenaline SPBio_001042 (+)-Isoproterenol CCG-204796 (S)-(+)-Isoproterenol d-N-Isopropylnorepinephrine 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)ethyl)- (9CI) DivK1c_000894 149-53-1 DSSTox_CID_3175 4-(1-Hydroxy-2(isopropylamino)ethyl)-benzene 1,2-diol FT-0724367 4-{1-hydroxy-2-[(methylethyl)amino]ethyl}benzene-1,2-diol Isonorene AB00053487-09 Isoprenalinesulphate Aleudrine Isopropylaminomethyl-3,4-dihydroxyphenyl carbinol Asmalar Isoproterenol,(+) BENZYL ALCOHOL, 3,4-DIHYDROXY-alpha-((ISOPROPYLAMINO)METHYL)-, (+-)- Spectrum3_000474 Isuprel (TN) to_000062 KBio2_006565 Lopac0_000711 N-Isopropylnoradrenaline NCGC00015558-10 neo-Epinine NSC-9975 Prestwick2_001097 Saventrine Bronkephrine (+/-)-isoprenaline D0IF0C 1,2-Benzenediol, 4-(1-hydroxy-2-((1-methylethyl)amino)ethyl)-, (S)- dl-Ipr 3,4-Dihydroxy-.alpha.-[(isopropylamino)methyl]benzyl alcohol DTXSID4023175 4-[1-Hydroxy-2-(isopropylamino)ethyl]-1,2-benzenediol # I14-45263 46388-38-9 Isoprenalina AB00053487_12 ISOPROP Aludrin Isopropylnorepinephrine BDBM25392 [ Show all ]
Inchi Key	JWZZKOKVBUJMES-UHFFFAOYSA-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
PubChem CID	3779
ChEMBL	CHEMBL434
IUPHAR	536
BindingDB	25392
DrugBank	DB01064
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	13.0 nM	PMID1354264	BindingDB,ChEMBL
EC50	87.1 nM	PMID11311067	BindingDB,ChEMBL
ED50	0.16 mg.kg-1	PMID1350309	ChEMBL
Intrinsic activity	0.99 -	PMID11311067	ChEMBL
Ki	5011.87 nM	PMID8719421	IUPHAR
SI	0.06 beats min-1	PMID1350309	ChEMBL

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