BDBM101023 US8507479, 655

SMILES: CC1(C)C[C@](C)(N=C(N)S1)c1cc(NC(=O)c2ncccc2F)ccn1

InChI Key: InChIKey=YDJXVZIDQIWZQL-SFHVURJKSA-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 = 101023   

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))	BDBM101023 (US8507479, 655) Show SMILES CC1(C)C[C@](C)(N=C(N)S1)c1cc(NC(=O)c2ncccc2F)ccn1 |r,t:6| Show InChI InChI=1S/C18H20FN5OS/c1-17(2)10-18(3,24-16(20)26-17)13-9-11(6-8-21-13)23-15(25)14-12(19)5-4-7-22-14/h4-9H,10H2,1-3H3,(H2,20,24)(H,21,23,25)/t18-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10	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))	BDBM101023 (US8507479, 655) Show SMILES CC1(C)C[C@](C)(N=C(N)S1)c1cc(NC(=O)c2ncccc2F)ccn1 |r,t:6| Show InChI InChI=1S/C18H20FN5OS/c1-17(2)10-18(3,24-16(20)26-17)13-9-11(6-8-21-13)23-15(25)14-12(19)5-4-7-22-14/h4-9H,10H2,1-3H3,(H2,20,24)(H,21,23,25)/t18-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10	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