BDBM50485430 CHEMBL2059816

SMILES: NC(=O)[C@@H](CCC(F)(F)F)N(CCC#N)S(=O)(=O)c1ccc(Cl)cc1

InChI Key: InChIKey=HBENWAJEVNKJSM-GFCCVEGCSA-N

Data: 1 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 1 hit for monomerid = 50485430   

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))	BDBM50485430 (CHEMBL2059816) Show SMILES NC(=O)[C@@H](CCC(F)(F)F)N(CCC#N)S(=O)(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C14H15ClF3N3O3S/c15-10-2-4-11(5-3-10)25(23,24)21(9-1-8-19)12(13(20)22)6-7-14(16,17)18/h2-5,12H,1,6-7,9H2,(H2,20,22)/t12-/m1/s1	PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of gamma secretase-mediated amyloid beta42 production in human H4 cells expressing human APP swedish mutant				J Med Chem 55: 3414-24 (2012) Article DOI: 10.1021/jm300094u BindingDB Entry DOI: 10.7270/Q23F4SHS
					More data for this Ligand-Target Pair