BDBM171816 US9085576, 2b-B::US9085576, 2b-rac

SMILES COc4cnc(C(=O)Nc3ccc(F)c(C2(C)N=C(N)O[C@@H]1C[C@@H]12)c3)cn4

InChI Key InChIKey=LUOFRFUNXXGHFC-UHFFFAOYSA-N

Data  5 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 = 171816   

TargetBeta-secretase 1(Human)
Amgen

US Patent
LigandPNGBDBM171816(US9611261, Example 2b-rac)
Affinity DataIC50: 604nMAssay Description:The assay buffer used in this screen is 0.05 M acetate, pH 4.2, 10% DMSO final, 100 uM genapol (which is a nonionic detergent, below its Critical Mic...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2019
Entry Details
US Patent

TargetBeta-secretase 1(Human)
Amgen

US Patent
LigandPNGBDBM171816(US9611261, Example 2b-rac)
Affinity DataIC50: 4.10E+4nMAssay Description:Inhibition of human BACE1More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/15/2020
Entry Details Article
PubMed
TargetCathepsin D(Human)
Amgen

US Patent
LigandPNGBDBM171816(US9611261, Example 2b-rac)
Affinity DataIC50: 8.13E+4nMAssay Description:Recombinant Cat D was expressed in CHO cells. The assay buffer for CathepsinD is 0.05 M citrate pH 3.5, 10% DMSO final, 5 mM CHAPS. The Cat D enzyme ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2019
Entry Details
US Patent