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BDBM50099149 5-{4-[4-((S)-2-Hydroxy-3-phenoxy-propylamino)-piperidin-1-yl]-benzylidene}-2-piperidin-1-yl-thiazol-4-one::CHEMBL171963

SMILES: O[C@@H](CNC1CCN(CC1)c1ccc(\C=C2/SC(=NC2=O)N2CCCCC2)cc1)COc1ccccc1

InChI Key: InChIKey=KUDKJOYIJGDSMU-BFPHOCLHSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50099149   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Beta-3 adrenergic receptor


(Homo sapiens (Human))		BDBM50099149
PNG
(5-{4-[4-((S)-2-Hydroxy-3-phenoxy-propylamino)-pipe...)
Show SMILES O[C@@H](CNC1CCN(CC1)c1ccc(\C=C2/SC(=NC2=O)N2CCCCC2)cc1)COc1ccccc1 |c:18|
Show InChI InChI=1S/C29H36N4O3S/c34-25(21-36-26-7-3-1-4-8-26)20-30-23-13-17-32(18-14-23)24-11-9-22(10-12-24)19-27-28(35)31-29(37-27)33-15-5-2-6-16-33/h1,3-4,7-12,19,23,25,30,34H,2,5-6,13-18,20-21H2/b27-19-/t25-/m0/s1
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Similars
PubMed
n/an/an/an/a 75n/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