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SMILES: COC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)N(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)Cc1ccccc1

InChI Key: InChIKey=KVWCNGKGFOHNMO-QWMXJGQVSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50143443   
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))		BDBM50143443
PNG
((S)-2-{(S)-2-[3-Benzyl-3-((2R,3S)-3-tert-butoxycar...)
Show SMILES COC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)N(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)Cc1ccccc1
Show InChI InChI=1S/C33H48N4O7/c1-22(2)18-27(29(39)34-23(3)30(40)43-7)35-31(41)37(20-25-16-12-9-13-17-25)21-28(38)26(19-24-14-10-8-11-15-24)36-32(42)44-33(4,5)6/h8-17,22-23,26-28,38H,18-21H2,1-7H3,(H,34,39)(H,35,41)(H,36,42)/t23-,26-,27-,28+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

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PC cid
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Similars
Article
PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



Harvard Medical School

Curated by ChEMBL


Assay Description
Inhibition of amyloid-beta production in Chinese hamster ovary (CHO) cells expressing human amyloid precursor protein (APP)

Bioorg Med Chem Lett 14: 1935-8 (2004)


Article DOI: 10.1016/j.bmcl.2004.01.077
BindingDB Entry DOI: 10.7270/Q2F19080
More data for this
Ligand-Target Pair