BDBM123859 US8748418, 3

SMILES: C[C@@]1(N=C(N)COC[C@@H]1F)c1cc(NC2CCOC2)ccc1F

InChI Key: InChIKey=UPNYTQSKKDHJPL-TWZNPMNKSA-N

Data: 2 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 2 hits for monomerid = 123859   

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 2 (Homo sapiens (Human))	BDBM123859 (US8748418, 3) Show SMILES C[C@@]1(N=C(N)COC[C@@H]1F)c1cc(NC2CCOC2)ccc1F |r,t:2| Show InChI InChI=1S/C16H21F2N3O2/c1-16(14(18)8-23-9-15(19)21-16)12-6-10(2-3-13(12)17)20-11-4-5-22-7-11/h2-3,6,11,14,20H,4-5,7-9H2,1H3,(H2,19,21)/t11?,14-,16+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	72	n/a	n/a	n/a	n/a	4.5	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description The FRET assay was performed essentially as described in Gruninger-Leitch et al., Journal of Biological Chemistry (2002) 277(7) 4687-93 (Substrate an...				US Patent US8748418 (2014) BindingDB Entry DOI: 10.7270/Q2C53JJP
					More data for this Ligand-Target Pair
Beta-secretase 1 (Homo sapiens (Human))	BDBM123859 (US8748418, 3) Show SMILES C[C@@]1(N=C(N)COC[C@@H]1F)c1cc(NC2CCOC2)ccc1F |r,t:2| Show InChI InChI=1S/C16H21F2N3O2/c1-16(14(18)8-23-9-15(19)21-16)12-6-10(2-3-13(12)17)20-11-4-5-22-7-11/h2-3,6,11,14,20H,4-5,7-9H2,1H3,(H2,19,21)/t11?,14-,16+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	580	n/a	n/a	n/a	n/a	4.5	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description The FRET assay was performed essentially as described in Gruninger-Leitch et al., Journal of Biological Chemistry (2002) 277(7) 4687-93 (Substrate an...				US Patent US8748418 (2014) BindingDB Entry DOI: 10.7270/Q2C53JJP
					More data for this Ligand-Target Pair