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Target
Beta-1 adrenergic receptor
Ligand
BDBM50418949
Substrate
n/a
Meas. Tech.
ChEMBL_759387 (CHEMBL1810625)
IC50
126±n/a nM
Citation
 Connolly, S; Alcaraz, L; Bailey, A; Cadogan, E; Christie, J; Cook, AR; Fisher, AJ; Hill, S; Humphries, A; Ingall, AH; Kane, Z; Paine, S; Pairaudeau, G; Stocks, MJ; Young, A Design-driven LO: the discovery of new ultra long acting dibasicß2-adrenoceptor agonists. Bioorg Med Chem Lett 21:4612-6 (2011) [PubMed]  Article 
Target
Name:
Beta-1 adrenergic receptor
Synonyms:
ADRB1 | ADRB1R | ADRB1_HUMAN | B1AR | Beta-1 adrenoceptor | adrenergic Beta1
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
51338.40
Organism:
Homo sapiens (Human)
Description:
P08588
Residue:
477
Sequence:
MGAGVLVLGASEPGNLSSAAPLPDGAATAARLLVPASPPASLLPPASESPEPLSQQWTAGMGLLMALIVLLIVAGNVLVIVAIAKTPRLQTLTNLFIMSLASADLVMGLLVVPFGATIVVWGRWEYGSFFCELWTSVDVLCVTASIETLCVIALDRYLAITSPFRYQSLLTRARARGLVCTVWAISALVSFLPILMHWWRAESDEARRCYNDPKCCDFVTNRAYAIASSVVSFYVPLCIMAFVYLRVFREAQKQVKKIDSCERRFLGGPARPPSPSPSPVPAPAPPPGPPRPAAAAATAPLANGRAGKRRPSRLVALREQKALKTLGIIMGVFTLCWLPFFLANVVKAFHRELVPDRLFVFFNWLGYANSAFNPIIYCRSPDFRKAFQRLLCCARRAARRRHATHGDRPRASGCLARPGPPPSPGAASDDDDDDVVGATPPARLLEPWAGCNGGAAADSDSSLDEPCRPGFASESKV
  
Inhibitor
Name:
BDBM50418949
Synonyms:
CHEMBL1807869
Type:
Small organic molecule
Emp. Form.:
C22H28ClN3O3S2
Mol. Mass.:
482.059
SMILES:
O[C@@H](CNCCCSCCNCCc1cccc(Cl)c1)c1ccc(O)c2[nH]c(=O)sc12 |r|
Structure:
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