BDBM50347194 CHEMBL1795746

SMILES: O=c1nc(oc2c3ccccc3c(OCc3cccnc3)cc12)N1CCOCC1

InChI Key: InChIKey=WOVCKSLFQANCCM-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 = 50347194   

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))	BDBM50347194 (CHEMBL1795746) Show SMILES O=c1nc(oc2c3ccccc3c(OCc3cccnc3)cc12)N1CCOCC1 Show InChI InChI=1S/C22H19N3O4/c26-21-18-12-19(28-14-15-4-3-7-23-13-15)16-5-1-2-6-17(16)20(18)29-22(24-21)25-8-10-27-11-9-25/h1-7,12-13H,8-11,14H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	717	n/a	n/a	n/a	n/a	n/a	n/a
La Trobe University Curated by ChEMBL					Assay Description Inhibition of purified DNA-PK by ADP-Glo Kinase assay				Bioorg Med Chem 19: 3983-94 (2011) Article DOI: 10.1016/j.bmc.2011.05.032 BindingDB Entry DOI: 10.7270/Q20Z73M7
					More data for this Ligand-Target Pair