Reaction Details Report a problem with these data
Target
Beta-2 adrenergic receptor
Ligand
BDBM50018591
Substrate
n/a
Meas. Tech.
ChEMBL_1362118 (CHEMBL3294890)
Ki
<10000±n/a nM
Citation
 Jacobsen, JR; Aggen, JB; Church, TJ; Klein, U; Pfeiffer, JW; Pulido-Rios, TM; Thomas, GR; Yu, C; Moran, EJ Multivalent design of long-actingß(2)-adrenoceptor agonists incorporating biarylamines. Bioorg Med Chem Lett 24:2625-30 (2014) [PubMed]  Article 
Target
Name:
Beta-2 adrenergic receptor
Synonyms:
ADRB2 | ADRB2R | ADRB2_HUMAN | B2AR | Beta-2 adrenoceptor | Beta-2 adrenoreceptor
Type:
n/a
Mol. Mass.:
46461.69
Organism:
Homo sapiens (Human)
Description:
P07550
Residue:
413
Sequence:
MGQPGNGSAFLLAPNGSHAPDHDVTQERDEVWVVGMGIVMSLIVLAIVFGNVLVITAIAKFERLQTVTNYFITSLACADLVMGLAVVPFGAAHILMKMWTFGNFWCEFWTSIDVLCVTASIETLCVIAVDRYFAITSPFKYQSLLTKNKARVIILMVWIVSGLTSFLPIQMHWYRATHQEAINCYANETCCDFFTNQAYAIASSIVSFYVPLVIMVFVYSRVFQEAKRQLQKIDKSEGRFHVQNLSQVEQDGRTGHGLRRSSKFCLKEHKALKTLGIIMGTFTLCWLPFFIVNIVHVIQDNLIRKEVYILLNWIGYVNSGFNPLIYCRSPDFRIAFQELLCLRRSSLKAYGNGYSSNGNTGEQSGYHVEQEKENKLLCEDLPGTEDFVGHQGTVPSDNIDSQGRNCSTNDSLL
  
Inhibitor
Name:
BDBM50018591
Synonyms:
CHEMBL3290972
Type:
Small organic molecule
Emp. Form.:
C24H26Cl2N2O3
Mol. Mass.:
461.381
SMILES:
OCc1cc(ccc1O)C(O)CNCCc1ccc(NCc2ccc(Cl)c(Cl)c2)cc1
Structure:
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