null

SMILES: CCNc1cc(cc(c1)C(=O)N[C@@H](Cn1cccn1)[C@H](O)CNCc1cccc(OC)c1)N1CCCCS1(=O)=O

InChI Key: InChIKey=OFELJLDMFBJYRB-RRPNLBNLSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 26784   

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))	BDBM26784 (3-(1,1-dioxo-1,2-thiazinan-2-yl)-5-(ethylamino)-N-...) Show SMILES CCNc1cc(cc(c1)C(=O)N[C@@H](Cn1cccn1)[C@H](O)CNCc1cccc(OC)c1)N1CCCCS1(=O)=O |r| Show InChI InChI=1S/C28H38N6O5S/c1-3-30-23-15-22(16-24(17-23)34-12-4-5-13-40(34,37)38)28(36)32-26(20-33-11-7-10-31-33)27(35)19-29-18-21-8-6-9-25(14-21)39-2/h6-11,14-17,26-27,29-30,35H,3-5,12-13,18-20H2,1-2H3,(H,32,36)/t26-,27+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.69E+3	n/a	n/a	n/a	n/a	4.5	22
GSK					Assay Description Enzyme activity and inhibition were assayed using a fluorescent FAM-[SEVNLDAEFK]-TAMRA substrate. Control reactions with no enzyme were included in e...				Bioorg Med Chem Lett 18: 1022-6 (2008) Article DOI: 10.1016/j.bmcl.2007.12.020 BindingDB Entry DOI: 10.7270/Q2MC8XBP
					More data for this Ligand-Target Pair
Cathepsin D (Homo sapiens (Human))	BDBM26784 (3-(1,1-dioxo-1,2-thiazinan-2-yl)-5-(ethylamino)-N-...) Show SMILES CCNc1cc(cc(c1)C(=O)N[C@@H](Cn1cccn1)[C@H](O)CNCc1cccc(OC)c1)N1CCCCS1(=O)=O |r| Show InChI InChI=1S/C28H38N6O5S/c1-3-30-23-15-22(16-24(17-23)34-12-4-5-13-40(34,37)38)28(36)32-26(20-33-11-7-10-31-33)27(35)19-29-18-21-8-6-9-25(14-21)39-2/h6-11,14-17,26-27,29-30,35H,3-5,12-13,18-20H2,1-2H3,(H,32,36)/t26-,27+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
GSK					Assay Description Enzyme activity and inhibition were assayed using a fluorescent FAM-[SEVNLDAEFK]-TAMRA substrate. Control reactions with no enzyme were included in e...				Bioorg Med Chem Lett 18: 1022-6 (2008) Article DOI: 10.1016/j.bmcl.2007.12.020 BindingDB Entry DOI: 10.7270/Q2MC8XBP
					More data for this Ligand-Target Pair
Beta-secretase 2 (Homo sapiens (Human))	BDBM26784 (3-(1,1-dioxo-1,2-thiazinan-2-yl)-5-(ethylamino)-N-...) Show SMILES CCNc1cc(cc(c1)C(=O)N[C@@H](Cn1cccn1)[C@H](O)CNCc1cccc(OC)c1)N1CCCCS1(=O)=O |r| Show InChI InChI=1S/C28H38N6O5S/c1-3-30-23-15-22(16-24(17-23)34-12-4-5-13-40(34,37)38)28(36)32-26(20-33-11-7-10-31-33)27(35)19-29-18-21-8-6-9-25(14-21)39-2/h6-11,14-17,26-27,29-30,35H,3-5,12-13,18-20H2,1-2H3,(H,32,36)/t26-,27+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
GSK					Assay Description Enzyme activity and inhibition were assayed using a fluorescent FAM-[SEVNLDAEFK]-TAMRA substrate. Control reactions with no enzyme were included in e...				Bioorg Med Chem Lett 18: 1022-6 (2008) Article DOI: 10.1016/j.bmcl.2007.12.020 BindingDB Entry DOI: 10.7270/Q2MC8XBP
					More data for this Ligand-Target Pair