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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 = 'BDBM50368393'   
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


(Rattus norvegicus-Rattus norvegicus (rat))		BDBM50368393
PNG
(CHEMBL612164)
Show SMILES CCCCCCC#Cc1ncnc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C18H24N4O4/c1-2-3-4-5-6-7-8-12-14-17(20-10-19-12)22(11-21-14)18-16(25)15(24)13(9-23)26-18/h10-11,13,15-16,18,23-25H,2-6,9H2,1H3/t13-,15-,16-,18?/m1/s1
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
>567n/an/an/an/an/an/an/an/a



Hokkaido University

Curated by ChEMBL


Assay Description
Binding affinity against adenosine A2 receptor in rat striatal membranes using [3H]NECA as radioligand

J Med Chem 35: 241-52 (1992)


BindingDB Entry DOI: 10.7270/Q20C4WD2
More data for this
Ligand-Target Pair