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Name | Beta-1 adrenergic receptor |
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Species | Homo sapiens (Human) |
Gene | ADRB1 |
Synonym | Adrenergic receptor beta 1 Adrb-1 ADRB1R adrenergic receptor beta 1-AR [ Show all ] |
Disease | Heart failure; Cardiogenic shock Heart failure Glaucoma Diabetes Coronary artery disease [ 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 |
Name | CHEMBL29141 |
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Molecular formula | C10H12N2O3S |
IUPAC name | 4-hydroxy-7-[1-hydroxy-2-(methylamino)ethyl]-3H-1,3-benzothiazol-2-one |
Molecular weight | 240.277 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 4 |
XlogP | 0.0 |
Synonyms | BDBM50077647 S 1319 2(3H)-Benzothiazolone, 4-hydroxy-7-[1-hydroxy-2-(methylamino)ethyl]- 4-hydroxy-7-(1-hydroxy-2-methylamino-ethyl)-3H-benzothiazol-2-one DTXSID50431209 [ Show all ] |
Inchi Key | AWWPNKWNJLNEKN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C10H12N2O3S/c1-11-4-7(14)5-2-3-6(13)8-9(5)16-10(15)12-8/h2-3,7,11,13-14H,4H2,1H3,(H,12,15) |
PubChem CID | 9816183 |
ChEMBL | CHEMBL29141 |
IUPHAR | N/A |
BindingDB | 50077647 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Kd | 120.0 nM | PMID10360736 | BindingDB,ChEMBL |
Ki | 60.6 nM | PMID20655218 | ChEMBL |
Ki | 61.0 nM | PMID20655218 | BindingDB |
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