Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A1' and Ligand = 'BDBM50392807'   

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))	BDBM50392807 (CHEMBL2151253) Show SMILES C[C@@H](Oc1ccccc1F)C(=O)Nc1nnc([nH]1)-c1ccccc1 |r| Show InChI InChI=1S/C17H15FN4O2/c1-11(24-14-10-6-5-9-13(14)18)16(23)20-17-19-15(21-22-17)12-7-3-2-4-8-12/h2-11H,1H3,(H2,19,20,21,22,23)/t11-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human A1 adenosine receptor expressed in CHO cells after 60 mins by liquid scintillation counting				ACS Med Chem Lett 3: 715-720 (2012) Article DOI: 10.1021/ml300097g BindingDB Entry DOI: 10.7270/Q27082HC
					More data for this Ligand-Target Pair