Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A3' and Ligand = 'BDBM50257151'   

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))	BDBM50257151 (4-(cyclohexylamino)-6-nitro-2-phenyl-[1,2,4]triazo...) Show SMILES [O-][N+](=O)c1cccc2c1nc(NC1CCCCC1)c1nn(-c3ccccc3)c(=O)n21 Show InChI InChI=1S/C21H20N6O3/c28-21-25-16-12-7-13-17(27(29)30)18(16)23-19(22-14-8-3-1-4-9-14)20(25)24-26(21)15-10-5-2-6-11-15/h2,5-7,10-14H,1,3-4,8-9H2,(H,22,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	281	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universita di Firenze Curated by ChEMBL					Assay Description Displacement of [125I]AB-MECA from human cloned adenosine A3 receptor expressed in CHO cells				J Med Chem 52: 2407-19 (2009) Article DOI: 10.1021/jm8014876 BindingDB Entry DOI: 10.7270/Q2X63MVV
					More data for this Ligand-Target Pair