BDBM50401470 CHEMBL244253

SMILES: CN1CCN(CCOc2ccc3c(c2)oc(nc3=O)N2CCOCC2)CC1

InChI Key: InChIKey=BDFPELHCCPJTFK-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 = 50401470   

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
DNA-dependent protein kinase catalytic subunit (Homo sapiens (Human))	BDBM50401470 (CHEMBL244253) Show SMILES CN1CCN(CCOc2ccc3c(c2)oc(nc3=O)N2CCOCC2)CC1 Show InChI InChI=1S/C19H26N4O4/c1-21-4-6-22(7-5-21)8-13-26-15-2-3-16-17(14-15)27-19(20-18(16)24)23-9-11-25-12-10-23/h2-3,14H,4-13H2,1H3	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
La Trobe University Curated by ChEMBL					Assay Description Inhibition of DNA-PK using EPPLSQEAFADLWKK as substrate after 5 mins by ADP-Glo kinase assay				Eur J Med Chem 57: 85-101 (2012) Article DOI: 10.1016/j.ejmech.2012.08.035 BindingDB Entry DOI: 10.7270/Q2XS5WK6
					More data for this Ligand-Target Pair