Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Adenosine receptor A2a/A2b' and Ligand = 'BDBM50367680'   

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 A2a/A2b (Rattus norvegicus-Rattus norvegicus (rat))	BDBM50367680 (CHEMBL605008) Show SMILES CC(Cc1ccccc1)Nc1cc(Cl)nc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C20H23ClN4O4/c1-11(7-12-5-3-2-4-6-12)23-13-8-15(21)24-19-16(13)22-10-25(19)20-18(28)17(27)14(9-26)29-20/h2-6,8,10-11,14,17-18,20,26-28H,7,9H2,1H3,(H,23,24)/t11?,14-,17-,18-,20?/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Camerino Curated by ChEMBL					Assay Description Displacement of [3H]NECA from A2-receptor of rat striatal membranes				J Med Chem 31: 1179-83 (1988) BindingDB Entry DOI: 10.7270/Q2QC042G
					More data for this Ligand-Target Pair
Adenosine receptor A2a/A2b (Homo sapiens (Human))	BDBM50367680 (CHEMBL605008) Show SMILES CC(Cc1ccccc1)Nc1cc(Cl)nc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C20H23ClN4O4/c1-11(7-12-5-3-2-4-6-12)23-13-8-15(21)24-19-16(13)22-10-25(19)20-18(28)17(27)14(9-26)29-20/h2-6,8,10-11,14,17-18,20,26-28H,7,9H2,1H3,(H,23,24)/t11?,14-,17-,18-,20?/m1/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a
Universit£ di Camerino Curated by ChEMBL					Assay Description Stimulation of adenylate cyclase activity in human platelet membrane at A2 receptor				J Med Chem 31: 1179-83 (1988) BindingDB Entry DOI: 10.7270/Q2QC042G
					More data for this Ligand-Target Pair