BDBM50078353 CHEMBL3414702

SMILES C[C@]1(CCSC(=N1)N)c2ccc(cc2F)F

InChI Key InChIKey=JRYNZJXSUKTLGF-UHFFFAOYSA-N

Data  1 IC50

PDB links: 1 PDB ID matches this monomer.

  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 1 hit for monomerid = 50078353   

TargetBeta-secretase 1(Human)
Eurofarma Laboratorios

Curated by ChEMBL
LigandPNGBDBM50078353(CHEMBL3414702)
Affinity DataIC50: 3.60E+4nMAssay Description:Inhibition of BACE1 (unknown origin) using biotin-GLTNIKTEEISEISYEVEFR-C[Oregon Green]KK-OH as substrate after 3 hrs by fluorescence polarization ass...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/26/2016
Entry Details Article
PubMedPDB3D3D Structure (crystal)