BDBM50322879 CHEMBL1210431::N-((2S,3R)-3-hydroxy-4-(6-methylheptan-2-ylamino)-1-phenylbutan-2-yl)-3-(N-phenylmethylsulfonamido)benzamide

SMILES CC(C)CCCC(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cccc(c1)N(c1ccccc1)S(C)(=O)=O

InChI Key InChIKey=HUCKKBDXVQDXSC-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50322879   

TargetBeta-secretase 1(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50322879(N-((2S,3R)-3-hydroxy-4-(6-methylheptan-2-ylamino)-...)
Affinity DataIC50: 32nMAssay Description:Inhibition of BACE1More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/31/2012
Entry Details Article
PubMed
TargetCathepsin D(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50322879(N-((2S,3R)-3-hydroxy-4-(6-methylheptan-2-ylamino)-...)
Affinity DataIC50: 207nMAssay Description:Inhibition of Cathepsin DMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/31/2012
Entry Details Article
PubMed
TargetBeta-secretase 2(Human)
Glaxosmithkline

Curated by ChEMBL
LigandPNGBDBM50322879(N-((2S,3R)-3-hydroxy-4-(6-methylheptan-2-ylamino)-...)
Affinity DataIC50: 780nMAssay Description:Inhibition of BACE2More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/31/2012
Entry Details Article
PubMed