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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A1' and Ligand = 'BDBM50176839'   
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
Adenosine receptor A1


(BOVINE)		BDBM50176839
PNG
(CHEMBL223821 | isopropyl 4-(2-chlorophenethylamino...)
Show SMILES CC(C)OC(=O)c1cnc2n(CC(Cl)c3ccccc3)ncc2c1NCCc1ccccc1Cl
Show InChI InChI=1S/C26H26Cl2N4O2/c1-17(2)34-26(33)21-14-30-25-20(24(21)29-13-12-19-10-6-7-11-22(19)27)15-31-32(25)16-23(28)18-8-4-3-5-9-18/h3-11,14-15,17,23H,12-13,16H2,1-2H3,(H,29,30)
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Similars
Article
PubMed
 44n/an/an/an/an/an/an/an/a



Università degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from adenosine A1 receptor in bovine cerebral cortical membranes

J Med Chem 48: 7172-85 (2005)


Article DOI: 10.1021/jm050407k
BindingDB Entry DOI: 10.7270/Q2N0163Q
More data for this
Ligand-Target Pair