Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A1' and Ligand = 'BDBM50014291'   

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 (Rattus norvegicus (rat))	BDBM50014291 (2-(2-Chloro-phenyl)-5,6-dimethyl-7H-pyrrolo[2,3-d]...) Show SMILES Cc1[nH]c2nc(nc(N)c2c1C)-c1ccccc1Cl Show InChI InChI=1S/C14H13ClN4/c1-7-8(2)17-14-11(7)12(16)18-13(19-14)9-5-3-4-6-10(9)15/h3-6H,1-2H3,(H3,16,17,18,19)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.17E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institute of Diabetes Curated by ChEMBL					Assay Description Binding affinity against Adenosine A1 receptor from rat brain membrane using [3H]-R-PIA as radioligand				J Med Chem 33: 2822-8 (1990) BindingDB Entry DOI: 10.7270/Q27D2T4D
					More data for this Ligand-Target Pair