BDBM50398690 CHEMBL2178712

SMILES COc1cccnc1N1C[C@H]2C(=O)N(C)C(N)=N[C@@]2(c2cc(-c3cccc(C#N)c3)cs2)C1

InChI Key InChIKey=OVZBZLASXPSCEA-UHFFFAOYSA-N

Data  1 KI  1 IC50

  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 = 50398690   

TargetBeta-secretase 1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50398690BDBM50398690(CHEMBL2178712)
Affinity DataKi:  3nMAssay Description:Inhibition of BACE1More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed
TargetBeta-secretase 1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50398690BDBM50398690(CHEMBL2178712)
Affinity DataIC50: 23nMAssay Description:Inhibition of BACE1 in HEK293 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2013
Entry Details Article
PubMed