BDBM50397267 CHEMBL2169937

SMILES: Cn1c(N)nc(cc1=O)[C@H]1C[C@H]1c1ccc(cc1)-c1ccccc1

InChI Key: InChIKey=DBMVKTRRCAVWIY-IRXDYDNUSA-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 = 50397267   

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))	BDBM50397267 (CHEMBL2169937) Show SMILES Cn1c(N)nc(cc1=O)[C@H]1C[C@H]1c1ccc(cc1)-c1ccccc1 |r| Show InChI InChI=1S/C20H19N3O/c1-23-19(24)12-18(22-20(23)21)17-11-16(17)15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10,12,16-17H,11H2,1H3,(H2,21,22)/t16-,17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.56E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi& Co., Ltd. Curated by ChEMBL					Assay Description Inhibition of human recombinant BACE1 using biotin-XSEVNLDAEFRHDSGC-Eu as substrate after 3 hrs by HTRF assay				J Med Chem 55: 8838-58 (2012) Article DOI: 10.1021/jm3011405 BindingDB Entry DOI: 10.7270/Q2W66MXK
					More data for this Ligand-Target Pair