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SMILES: CCOC(=O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](NC(=O)\C=C\c1ccccc1)C(C)C

InChI Key: InChIKey=HDQPLPMETHVQRE-RBBYZGPNSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50125673   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Gamma-secretase subunit APH-1A/Gamma-secretase subunit APH-1B/Gamma-secretase subunit PEN-2/Nicastrin/Presenilin-1/Presenilin-2


(Homo sapiens (Human))		BDBM50125673
PNG
((2R,3S)-4-Cyclohexyl-2-hydroxy-3-{(S)-3-methyl-2-[...)
Show SMILES CCOC(=O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@@H](NC(=O)\C=C\c1ccccc1)C(C)C
Show InChI InChI=1S/C26H38N2O5/c1-4-33-26(32)24(30)21(17-20-13-9-6-10-14-20)27-25(31)23(18(2)3)28-22(29)16-15-19-11-7-5-8-12-19/h5,7-8,11-12,15-16,18,20-21,23-24,30H,4,6,9-10,13-14,17H2,1-3H3,(H,27,31)(H,28,29)/b16-15+/t21-,23-,24+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of amyloid beta protein production in transfected H4 (neuroglioma) cells expressing APF constructs.

Bioorg Med Chem Lett 13: 1203-6 (2003)


BindingDB Entry DOI: 10.7270/Q279442Z
More data for this
Ligand-Target Pair