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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A2a/A2b' and Ligand = 'BDBM50047252'   
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 A2a/A2b


(Homo sapiens (Human))		BDBM50047252
PNG
(7-But-3-enyl-1-methyl-3-propyl-3,7-dihydro-purine-...)
Show SMILES CCCn1c2ncn(CCC=C)c2c(=O)n(C)c1=O
Show InChI InChI=1S/C13H18N4O2/c1-4-6-8-16-9-14-11-10(16)12(18)15(3)13(19)17(11)7-5-2/h4,9H,1,5-8H2,2-3H3
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 5.60E+3n/an/an/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor of striatal membrane using [3H]CGS-21680 as a radioligand

J Med Chem 36: 1380-6 (1993)


BindingDB Entry DOI: 10.7270/Q23B5Z65
More data for this
Ligand-Target Pair