null

SMILES: CCC[C@H](NC1CCc2cccc(Cl)c2C1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1

InChI Key: InChIKey=ZQZDVBKDVXHBPB-AKRCKQFNSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50483769   

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
Presenilin-1 (Homo sapiens (Human))	BDBM50483769 (CHEMBL1770908) Show SMILES CCC[C@H](NC1CCc2cccc(Cl)c2C1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C26H38ClN5O/c1-4-8-23(29-20-12-11-19-9-7-10-22(27)21(19)15-20)25(33)30-24-16-32(18-28-24)26(2,3)17-31-13-5-6-14-31/h7,9-10,16,18,20,23,29H,4-6,8,11-15,17H2,1-3H3,(H,30,33)/t20?,23-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human HeLa cells assessed as inhibition of amyloid beta (1 to 40) production by DELFIA-based immunoassay				Bioorg Med Chem Lett 21: 2637-40 (2011) Article DOI: 10.1016/j.bmcl.2010.12.118 BindingDB Entry DOI: 10.7270/Q2FF3W75
					More data for this Ligand-Target Pair
Presenilin-1 (Homo sapiens (Human))	BDBM50483769 (CHEMBL1770908) Show SMILES CCC[C@H](NC1CCc2cccc(Cl)c2C1)C(=O)Nc1cn(cn1)C(C)(C)CN1CCCC1 |r| Show InChI InChI=1S/C26H38ClN5O/c1-4-8-23(29-20-12-11-19-9-7-10-22(27)21(19)15-20)25(33)30-24-16-32(18-28-24)26(2,3)17-31-13-5-6-14-31/h7,9-10,16,18,20,23,29H,4-6,8,11-15,17H2,1-3H3,(H,30,33)/t20?,23-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	47	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma-secretase in human H4 cells expressing APP Swedish mutant assessed as inhibition of amyloid beta (1 to 40) production by whole ce...				Bioorg Med Chem Lett 21: 2637-40 (2011) Article DOI: 10.1016/j.bmcl.2010.12.118 BindingDB Entry DOI: 10.7270/Q2FF3W75
					More data for this Ligand-Target Pair