null

SMILES: C[C@]1(CCSC(N)=N1)c1cc(NC(=O)c2cnc(NCC(F)(F)F)cn2)ccc1F

InChI Key: InChIKey=YTISVJNOJAZCLS-KRWDZBQOSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 101034   

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))	BDBM101034 (US8507479, 702) Show SMILES C[C@]1(CCSC(N)=N1)c1cc(NC(=O)c2cnc(NCC(F)(F)F)cn2)ccc1F |r,c:6| Show InChI InChI=1S/C18H18F4N6OS/c1-17(4-5-30-16(23)28-17)11-6-10(2-3-12(11)19)27-15(29)13-7-25-14(8-24-13)26-9-18(20,21)22/h2-3,6-8H,4-5,9H2,1H3,(H2,23,28)(H,25,26)(H,27,29)/t17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	160	n/a	n/a	n/a	n/a	7.0	n/a
Shionogi & Co., Ltd. US Patent					Assay Description Inhibition assay using human BACE-1.				US Patent US8541408 (2013) BindingDB Entry DOI: 10.7270/Q2KK99D8
					More data for this Ligand-Target Pair
Beta-secretase 1 (Homo sapiens (Human))	BDBM101034 (US8507479, 702) Show SMILES C[C@]1(CCSC(N)=N1)c1cc(NC(=O)c2cnc(NCC(F)(F)F)cn2)ccc1F |r,c:6| Show InChI InChI=1S/C18H18F4N6OS/c1-17(4-5-30-16(23)28-17)11-6-10(2-3-12(11)19)27-15(29)13-7-25-14(8-24-13)26-9-18(20,21)22/h2-3,6-8H,4-5,9H2,1H3,(H2,23,28)(H,25,26)(H,27,29)/t17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi & Co., Ltd. US Patent					Assay Description Beta-Secretase inhibition assay.				US Patent US8507479 (2013) BindingDB Entry DOI: 10.7270/Q2KS6Q6G
					More data for this Ligand-Target Pair