Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A2a' and Ligand = 'BDBM50034383'   

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 (Rattus norvegicus (rat))	BDBM50034383 (1-(3-Amino-phenyl)-3-methyl-1H-chromeno[2,3-c]pyra...) Show SMILES Cc1nn(-c2cccc(N)c2)c2oc3ccccc3c(=O)c12 Show InChI InChI=1S/C17H13N3O2/c1-10-15-16(21)13-7-2-3-8-14(13)22-17(15)20(19-10)12-6-4-5-11(18)9-12/h2-9H,18H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Firenze Curated by ChEMBL					Assay Description Binding activity against Adenosine A2A receptor using [3H]-CGS- 21680 as a radioligand.				J Med Chem 38: 1330-6 (1995) BindingDB Entry DOI: 10.7270/Q27S7MTK
					More data for this Ligand-Target Pair