Target
Beta-2 adrenergic receptor
Ligand
BDBM50518969
Substrate
n/a
Meas. Tech.
ChEMBL_1873771 (CHEMBL4375060)
Ki
0.436516±n/a nM
Citation
 Gaiser, BIDanielsen, MMarcher-Rørsted, ERøpke Jørgensen, KWróbel, TMFrykman, MJohansson, HBräuner-Osborne, HGloriam, DEMathiesen, JMSejer Pedersen, D Probing the Existence of a Metastable Binding Site at the ? J Med Chem 62:7806-7839 (2019) [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:
BDBM50518969
Synonyms:
CHEMBL4514723
Type:
Small organic molecule
Emp. Form.:
C36H55N9O4
Mol. Mass.:
677.8798
SMILES:
CC(C)NC[C@H](O)COc1ccccc1CCCn1cc(CNCc2cn(CCCc3ccccc3OC[C@@H](O)CNC(C)C)nn2)nn1 |r|
Structure:
Search PDB for entries with ligand similarity: