Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A2a' and Ligand = 'BDBM50156648'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Adenosine receptor A2a (Rattus norvegicus (rat))	BDBM50156648 ((7RS,9aRS)-[2-(5-amino-2-furan-2-yl-[1,2,4]triazol...) Show SMILES Nc1nc(cc2nc(nn12)-c1ccco1)N1CCN2C[C@H](CO)CC[C@H]2C1 |r| Show InChI InChI=1S/C18H23N7O2/c19-18-21-15(8-16-20-17(22-25(16)18)14-2-1-7-27-14)24-6-5-23-9-12(11-26)3-4-13(23)10-24/h1-2,7-8,12-13,26H,3-6,9-11H2,(H2,19,21)/t12-,13+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	240	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biogen Idec Inc. Curated by ChEMBL					Assay Description Displacement of [3H]ZM241385 from adenosine A2A receptor in rat brain membrane				J Med Chem 47: 6218-29 (2004) Article DOI: 10.1021/jm0494321 BindingDB Entry DOI: 10.7270/Q20V8DM9
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