BDBM50036598 CHEMBL3353631

SMILES [H][C@]1(C[C@@]2(CCC3CCCCC3)NC(=N)N(C)C2=O)CCCN(C1)C(=O)OC(C)(C)C

InChI Key InChIKey=ABOIZKMFUAANLN-UHFFFAOYSA-N

Data  2 KI

  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 = 50036598   

TargetBeta-secretase 1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50036598(CHEMBL3353631)
Affinity DataKi:  2.90E+4nMAssay Description:Inhibition of purified human BACE1 by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/15/2016
Entry Details Article
PubMed
TargetCathepsin D(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50036598(CHEMBL3353631)
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of cathepsin-D (unknown origin)More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/15/2016
Entry Details Article
PubMed