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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 = 'BDBM50063190'   
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)		BDBM50063190
PNG
(CHEMBL159178 | [3-(2-Chloro-benzyl)-3H-[1,2,3]tria...)
Show SMILES CC(Cc1ccccc1)Nc1ncnc2n(Cc3ccccc3Cl)nnc12
Show InChI InChI=1S/C20H19ClN6/c1-14(11-15-7-3-2-4-8-15)24-19-18-20(23-13-22-19)27(26-25-18)12-16-9-5-6-10-17(16)21/h2-10,13-14H,11-12H2,1H3,(H,22,23,24)
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Similars
Article
PubMed
 73n/an/an/an/an/an/an/an/a



Università di Pisa

Curated by ChEMBL


Assay Description
Compound was tested for binding affinity at Adenosine A1 receptor in bovine brain cortical membranes using [3H]-(R)-(-)-N6-(2-phenylisopropyl)adenosi...

J Med Chem 41: 668-73 (1998)


Article DOI: 10.1021/jm9701334
BindingDB Entry DOI: 10.7270/Q2CR5SG9
More data for this
Ligand-Target Pair