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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 = 'BDBM50099156'   
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))		BDBM50099156
PNG
(CHEMBL174534 | N'-(5-{4-[4-((S)-2-Hydroxy-3-phenox...)
Show SMILES CN(C)C(=N)NC1=NC(=O)C(S1)=Cc1ccc(cc1)N1CCC(CC1)NC[C@H](O)COc1ccccc1 |w:12.13,t:6|
Show InChI InChI=1S/C27H34N6O3S/c1-32(2)26(28)31-27-30-25(35)24(37-27)16-19-8-10-21(11-9-19)33-14-12-20(13-15-33)29-17-22(34)18-36-23-6-4-3-5-7-23/h3-11,16,20,22,29,34H,12-15,17-18H2,1-2H3,(H2,28,30,31,35)/t22-/m0/s1
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PubMed
n/an/an/an/a 940n/an/an/an/a



Wyeth-Ayerst Research

Curated by ChEMBL


Assay Description
Beta 3-adrenergic receptor agonistic activity, evaluated by measurement of cAMP accumulation in CHO cells.

Bioorg Med Chem Lett 11: 981-4 (2001)


BindingDB Entry DOI: 10.7270/Q2125RZ5
More data for this
Ligand-Target Pair