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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 Ligand = 'BDBM50265528'   
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))
BDBM50265528
PNG
(CHEMBL4089669)
Show SMILES Cc1n[nH]c2cc(OCCNC[C@H](O)c3cccc(NS(=O)(=O)c4ccccc4)c3)ccc12 |r|
Show InChI InChI=1S/C24H26N4O4S/c1-17-22-11-10-20(15-23(22)27-26-17)32-13-12-25-16-24(29)18-6-5-7-19(14-18)28-33(30,31)21-8-3-2-4-9-21/h2-11,14-15,24-25,28-29H,12-13,16H2,1H3,(H,26,27)/t24-/m0/s1
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Similars

Article
PubMed
n/an/an/an/a 3.90n/an/an/an/a



Asahi Kasei Pharma Corporation

Curated by ChEMBL


Assay Description
Agonist activity at recombinant human beta3 adrenergic receptor expressed in CHO cells assessed as accumulation of cyclic AMP after 30 mins


J Med Chem 60: 3252-3265 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01197
BindingDB Entry DOI: 10.7270/Q2M61NQX
More data for this
Ligand-Target Pair