Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Adenosine receptor A1' and Ligand = 'BDBM50156665'   

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))	BDBM50156665 ((S)-2-furan-2-yl-7-(hexahydro-pyrrolo[1,2-a]pyrazi...) Show SMILES Nc1cc(nc2nc(nn12)-c1ccco1)N1CCN2CCC[C@H]2C1 |r| Show InChI InChI=1S/C16H19N7O/c17-13-9-14(22-7-6-21-5-1-3-11(21)10-22)18-16-19-15(20-23(13)16)12-4-2-8-24-12/h2,4,8-9,11H,1,3,5-7,10,17H2/t11-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Biogen Idec Inc. Curated by ChEMBL					Assay Description Displacement of [3h]DPCPX from adenosine A receptor in rat cerebral cortex membrane				J Med Chem 47: 6218-29 (2004) Article DOI: 10.1021/jm0494321 BindingDB Entry DOI: 10.7270/Q20V8DM9
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