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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Beta-3 Adrenergic Receptor' and Monomerid = 50277505   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Beta-3 adrenergic receptor


(Homo sapiens (Human))
BDBM50277505
PNG
(3-(Cycloheptyloxy)-4'-(2-{[(2R)-2-hydroxy-2-phenyl...)
Show SMILES CS(=O)(=O)NC(=O)c1ccc(cc1OC1CCCCCC1)-c1ccc(CCNC[C@H](O)c2ccccc2)cc1
Show InChI InChI=1S/C31H38N2O5S/c1-39(36,37)33-31(35)28-18-17-26(21-30(28)38-27-11-7-2-3-8-12-27)24-15-13-23(14-16-24)19-20-32-22-29(34)25-9-5-4-6-10-25/h4-6,9-10,13-18,21,27,29,32,34H,2-3,7-8,11-12,19-20,22H2,1H3,(H,33,35)/t29-/m0/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 0.380n/an/an/an/a



Astellas Pharma Inc.

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant beta3 adrenergic receptor expressed in CHO cells assessed as cAMP accumulation by enzyme immunoassay


J Med Chem 52: 3063-72 (2009)


Article DOI: 10.1021/jm9000709
BindingDB Entry DOI: 10.7270/Q2S75G6J
More data for this
Ligand-Target Pair