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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Beta-1 adrenergic receptor' and Ligand = 'BDBM50015194'   
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-1 adrenergic receptor


(Homo sapiens (Human))		BDBM50015194
PNG
(CHEMBL11629 | N-[4-(2-Hydroxy-3-{2-[4-(2-methyl-im...)
Show SMILES Cc1nccn1-c1ccc(OCCNCC(O)COc2ccc(NS(C)(=O)=O)cc2)cc1
Show InChI InChI=1S/C22H28N4O5S/c1-17-24-11-13-26(17)19-5-9-21(10-6-19)30-14-12-23-15-20(27)16-31-22-7-3-18(4-8-22)25-32(2,28)29/h3-11,13,20,23,25,27H,12,14-16H2,1-2H3
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PubMed
n/an/a 2.80E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
In vitro Beta-1 adrenergic receptor affinity in partially purified membrane fractions from canine cardiac tissue using [SH]dihydroalprenolol (4.5 nM)

J Med Chem 33: 1087-90 (1990)


BindingDB Entry DOI: 10.7270/Q2DB82FG
More data for this
Ligand-Target Pair