Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A3' and Ligand = 'BDBM50427594'   

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 A3 (Homo sapiens (Human))	BDBM50427594 (CHEMBL2322928) Show SMILES Cc1nc(NC(=O)c2ccncc2)c2nn(cc2n1)-c1ccccc1 Show InChI InChI=1S/C18H14N6O/c1-12-20-15-11-24(14-5-3-2-4-6-14)23-16(15)17(21-12)22-18(25)13-7-9-19-10-8-13/h2-11H,1H3,(H,20,21,22,25)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Firenze Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human A3 adenosine receptor expressed in CHO cells after 60 mins by scintillation counting analysis				J Med Chem 56: 2256-69 (2013) Article DOI: 10.1021/jm400068e BindingDB Entry DOI: 10.7270/Q29K4CKZ
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