BDBM50145003 CHEMBL3765732

SMILES: COc1cc2ncnc(-n3nc(nc3N)-c3ccncc3)c2cc1OC

InChI Key: InChIKey=HIKFNYCOMWJFCU-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50145003   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50145003 (CHEMBL3765732) Show SMILES COc1cc2ncnc(-n3nc(nc3N)-c3ccncc3)c2cc1OC Show InChI InChI=1S/C17H15N7O2/c1-25-13-7-11-12(8-14(13)26-2)20-9-21-16(11)24-17(18)22-15(23-24)10-3-5-19-6-4-10/h3-9H,1-2H3,(H2,18,22,23)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Duke University School of Medicine Curated by ChEMBL					Assay Description Inhibition of ATM kinase in human MCF7 cells after 1 hr by immunofluorescence assay				J Med Chem 59: 559-77 (2016) BindingDB Entry DOI: 10.7270/Q2TM7D0W
					More data for this Ligand-Target Pair