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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Beta-2 adrenergic receptor' and Ligand = 'BDBM50477620'   
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-2 adrenergic receptor


(Homo sapiens (Human))
BDBM50477620
PNG
(CHEMBL393469)
Show SMILES C[C@H](CNc1cccc(c1)-c1nc(co1)C(O)=O)NC[C@H](O)c1cccc(Cl)c1
Show InChI InChI=1S/C21H22ClN3O4/c1-13(23-11-19(26)14-4-2-6-16(22)8-14)10-24-17-7-3-5-15(9-17)20-25-18(12-29-20)21(27)28/h2-9,12-13,19,23-24,26H,10-11H2,1H3,(H,27,28)/t13-,19+/m1/s1
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PC cid
PC sid
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Article
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n/an/an/an/a 126n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human beta-2 adrenergic receptor expressed in CHO cells assessed as cAMP accumulation


Bioorg Med Chem Lett 17: 4670-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.069
BindingDB Entry DOI: 10.7270/Q2NV9N1V
More data for this
Ligand-Target Pair