Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A1' and Ligand = 'BDBM50063189'   

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 (BOVINE)	BDBM50063189 (CHEMBL158598 | [3-(2-Chloro-benzyl)-3H-[1,2,3]tria...) Show SMILES Cc1ccc(Nc2ncnc3n(Cc4ccccc4Cl)nnc23)cc1 Show InChI InChI=1S/C18H15ClN6/c1-12-6-8-14(9-7-12)22-17-16-18(21-11-20-17)25(24-23-16)10-13-4-2-3-5-15(13)19/h2-9,11H,10H2,1H3,(H,20,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	119	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Compound was tested for binding affinity at Adenosine A1 receptor in bovine brain cortical membranes using [3H]-(R)-(-)-N6-(2-phenylisopropyl)adenosi...				J Med Chem 41: 668-73 (1998) Article DOI: 10.1021/jm9701334 BindingDB Entry DOI: 10.7270/Q2CR5SG9
					More data for this Ligand-Target Pair