BDBM120383 US8703785, 478

SMILES: COCCOc1cnc(cn1)C(=O)Nc1cccc(CNc2cccnc2N)c1

InChI Key: InChIKey=GXWIPFVJHSXRGD-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 = 120383   

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
Beta-secretase 1 (Homo sapiens (Human))	BDBM120383 (US8703785, 478) Show SMILES COCCOc1cnc(cn1)C(=O)Nc1cccc(CNc2cccnc2N)c1 Show InChI InChI=1S/C20H22N6O3/c1-28-8-9-29-18-13-24-17(12-25-18)20(27)26-15-5-2-4-14(10-15)11-23-16-6-3-7-22-19(16)21/h2-7,10,12-13,23H,8-9,11H2,1H3,(H2,21,22)(H,26,27)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.18E+3	n/a	n/a	n/a	n/a	7.0	30
Shionogi & Co., Ltd. US Patent					Assay Description First, 48.5 μl portions of a solution of substrate peptide (Biotin-XSEVNLDAEFRHDSGC-Eu: X=ε-amino-n-capronic acid, Eu=Europium cryptate) we...				US Patent US8703785 (2014) BindingDB Entry DOI: 10.7270/Q2MW2FSM
					More data for this Ligand-Target Pair