BDBM116280 US8637504, 33::US9273053, 33

SMILES: COCCOc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)C=CSC(N)=N1

InChI Key: InChIKey=YJZQEEVMBLREDL-FQEVSTJZSA-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 = 116280   

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))	BDBM116280 (US8637504, 33 | US9273053, 33) Show SMILES COCCOc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)C=CSC(N)=N1 |r,c:25,29| Show InChI InChI=1S/C20H21FN4O3S/c1-20(7-10-29-19(22)25-20)15-11-13(3-5-16(15)21)24-18(26)17-6-4-14(12-23-17)28-9-8-27-2/h3-7,10-12H,8-9H2,1-2H3,(H2,22,25)(H,24,26)/t20-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	73	n/a	n/a	n/a	n/a	5.0	n/a
Shionogi & Co., Ltd. US Patent					Assay Description 48.5 μL of substrate peptide solution (Biotin-XSEVNLDAEFRHDSGC-Eu: X=ε-amino-n-capronic acid, Eu=Europium cryptate) was added to each well ...				US Patent US9273053 (2016) BindingDB Entry DOI: 10.7270/Q24Q7SVG
					More data for this Ligand-Target Pair
Beta-secretase 1 (Homo sapiens (Human))	BDBM116280 (US8637504, 33 | US9273053, 33) Show SMILES COCCOc1ccc(nc1)C(=O)Nc1ccc(F)c(c1)[C@]1(C)C=CSC(N)=N1 |r,c:25,29| Show InChI InChI=1S/C20H21FN4O3S/c1-20(7-10-29-19(22)25-20)15-11-13(3-5-16(15)21)24-18(26)17-6-4-14(12-23-17)28-9-8-27-2/h3-7,10-12H,8-9H2,1-2H3,(H2,22,25)(H,24,26)/t20-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	73	n/a	n/a	n/a	n/a	5.0	30
Shionogi & Co., Ltd. US Patent					Assay Description 48.5 μL of substrate peptide solution (Biotin-XSEVNLDAEFRHDSGC-Eu: X=ε-amino-n-capronic acid, Eu=Europium cryptate) was added to each well ...				US Patent US8637504 (2014) BindingDB Entry DOI: 10.7270/Q2DN43Q2
					More data for this Ligand-Target Pair