Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase Chk2' and Ligand = 'BDBM50335673'   

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))	BDBM50335673 ((S)-2-(7-methoxy-4-(pyrrolidin-3-ylamino)quinazoli...) Show SMILES COc1ccc2c(N[C@H]3CCNC3)nc(nc2c1)-c1ccccc1O |r| Show InChI InChI=1S/C19H20N4O2/c1-25-13-6-7-14-16(10-13)22-19(15-4-2-3-5-17(15)24)23-18(14)21-12-8-9-20-11-12/h2-7,10,12,20,24H,8-9,11H2,1H3,(H,21,22,23)/t12-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	29	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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