Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase Chk2' and Ligand = 'BDBM50335646'   

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
Serine/threonine-protein kinase Chk2 (Homo sapiens (Human))	BDBM50335646 ((R)-2-(4-(3-(dimethylamino)pyrrolidin-1-yl)quinazo...) Show SMILES CN(C)[C@@H]1CCN(C1)c1nc(nc2ccccc12)-c1cc(F)ccc1O |r| Show InChI InChI=1S/C20H21FN4O/c1-24(2)14-9-10-25(12-14)20-15-5-3-4-6-17(15)22-19(23-20)16-11-13(21)7-8-18(16)26/h3-8,11,14,26H,9-10,12H2,1-2H3/t14-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	860	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Cancer Research Curated by ChEMBL					Assay Description Inhibition of CHK2 by DELFIA assay				J Med Chem 54: 580-90 (2011) Article DOI: 10.1021/jm101150b BindingDB Entry DOI: 10.7270/Q2DF6RHX
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