Reaction Details Report a problem with these data
Target
Beta-3 adrenergic receptor
Ligand
BDBM50021884
Substrate
n/a
Meas. Tech.
ChEMBL_1369178
EC50
40±n/a nM
Citation
 McKinnell, RM; Klein, U; Linsell, MS; Moran, EJ; Nodwell, MB; Pfeiffer, JW; Thomas, GR; Yu, C; Jacobsen, JR Discovery of TD-4306, a long-actingß2-agonist for the treatment of asthma and COPD. Bioorg Med Chem Lett 24:2871-6 (2014) [PubMed]  Article 
Target
Name:
Beta-3 adrenergic receptor
Synonyms:
ADRB3 | ADRB3R | ADRB3_HUMAN | B3AR | Beta-2 adrenergic receptor and beta-3 adrenergic receptor | Beta-3 adrenoceptor | Beta-3 adrenoreceptor | adrenergic Beta3
Type:
G Protein-Coupled Receptor (GPCR)
Mol. Mass.:
43534.88
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
408
Sequence:
MAPWPHENSSLAPWPDLPTLAPNTANTSGLPGVPWEAALAGALLALAVLATVGGNLLVIVAIAWTPRLQTMTNVFVTSLAAADLVMGLLVVPPAATLALTGHWPLGATGCELWTSVDVLCVTASIETLCALAVDRYLAVTNPLRYGALVTKRCARTAVVLVWVVSAAVSFAPIMSQWWRVGADAEAQRCHSNPRCCAFASNMPYVLLSSSVSFYLPLLVMLFVYARVFVVATRQLRLLRGELGRFPPEESPPAPSRSLAPAPVGTCAPPEGVPACGRRPARLLPLREHRALCTLGLIMGTFTLCWLPFFLANVLRALGGPSLVPGPAFLALNWLGYANSAFNPLIYCRSPDFRSAFRRLLCRCGRRLPPEPCAAARPALFPSGVPAARSSPAQPRLCQRLDGASWGVS
  
Inhibitor
Name:
BDBM50021884
Synonyms:
CHEMBL3298897
Type:
Small organic molecule
Emp. Form.:
C31H37N5O4
Mol. Mass.:
543.6566
SMILES:
O[C@@H](CNCCc1ccc(Nc2ccc(OCCN3CCNCC3)cc2)cc1)c1ccc(O)c2[nH]c(=O)ccc12 |r|
Structure:
Search PDB for entries with ligand similarity: