BDBM50036574 CHEMBL3354250

SMILES CN1C(=N)N[C@](CCC2CCCCC2)(C[C@H]2CCC[C@H](C2)NC2CCCC2)C1=O

InChI Key InChIKey=NOZCXTAZEGFFAQ-XZDHIHRUSA-N

Data  2 KI

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50036574   

TargetBeta-secretase 1(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50036574(CHEMBL3354250)
Affinity DataKi:  430nMAssay Description:Inhibition of purified human BACE1 by FRET assayMore data for this Ligand-Target Pair
TargetCathepsin D(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50036574(CHEMBL3354250)
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of cathepsin-D (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed