Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A1' and Ligand = 'BDBM50202562'   

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 A1 (Homo sapiens (Human))	BDBM50202562 (1-deoxy-1-{6-[N'-(1-methyl-4-nitro-1H-imidazole-2-...) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NNC(=O)c3nc(cn3C)[N+]([O-])=O)ncnc12 |r| Show InChI InChI=1S/C17H20N10O7/c1-3-18-15(30)11-9(28)10(29)17(34-11)26-6-21-8-12(19-5-20-13(8)26)23-24-16(31)14-22-7(27(32)33)4-25(14)2/h4-6,9-11,17,28-29H,3H2,1-2H3,(H,18,30)(H,24,31)(H,19,20,23)/t9-,10+,11-,17+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Ferrara Curated by ChEMBL					Assay Description Displacement of [3H]CHA from human adenosine A1 receptor expressed in CHO cells				J Med Chem 50: 374-80 (2007) Article DOI: 10.1021/jm061170a BindingDB Entry DOI: 10.7270/Q2F76DDP
					More data for this Ligand-Target Pair