Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine-protein kinase ATM' and Ligand = 'BDBM245530'   

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-protein kinase ATM (Homo sapiens (Human))	BDBM245530 (US9428503, 58) Show SMILES Cn1c2cnc3ccc(cc3c2n(C2CCC2)c1=O)-c1ccc(OCCCN2CCCC2)nc1 Show InChI InChI=1S/C27H31N5O2/c1-30-24-18-28-23-10-8-19(16-22(23)26(24)32(27(30)33)21-6-4-7-21)20-9-11-25(29-17-20)34-15-5-14-31-12-2-3-13-31/h8-11,16-18,21H,2-7,12-15H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.310	n/a	n/a	n/a	n/a	n/a	37
AstraZeneca AB US Patent					Assay Description Assay a) HT29 cells (ECACC #85061109) were seeded into 384 well assay plates (Costar #3712) at a density of 3500 cells/well in 40 μl EMEM medium c...				US Patent US9428503 (2016) BindingDB Entry DOI: 10.7270/Q2GH9GVJ
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