BDBM50059638 CHEMBL3393499

SMILES: O=c1cc(nc2c(cccn12)-c1cccc2c3ccccc3sc12)N1CCOCC1

InChI Key: InChIKey=BFZXWQWGWIKIDD-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 = 50059638   

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))	BDBM50059638 (CHEMBL3393499) Show SMILES O=c1cc(nc2c(cccn12)-c1cccc2c3ccccc3sc12)N1CCOCC1 Show InChI InChI=1S/C24H19N3O2S/c28-22-15-21(26-11-13-29-14-12-26)25-24-19(8-4-10-27(22)24)18-7-3-6-17-16-5-1-2-9-20(16)30-23(17)18/h1-10,15H,11-14H2	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
University Hospital Hradec Kralove Curated by ChEMBL					Assay Description Inhibition of DNA-PK (unknown origin)				J Med Chem 58: 41-71 (2015) Article DOI: 10.1021/jm501026z BindingDB Entry DOI: 10.7270/Q2P84DJ7
					More data for this Ligand-Target Pair