BDBM314319 (S)-2-Methylamino-N-[(S)-2-oxo-1-(2,3,5,6-tetramethyl-benzyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-yl]-propionamide hydrochloride::US9611224, Example 47ll

SMILES CN[C@@H](C)C(=O)N[C@H]1CCc2ccccc2N(Cc2c(C)c(C)cc(C)c2C)C1=O

InChI Key InChIKey=NMXDDPLKAHJLJT-UHFFFAOYSA-N

Data  2 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 = 314319   

TargetBaculoviral IAP repeat-containing protein 2(Human)
Hoffmann-La Roche

US Patent
LigandChemical structure of BindingDB Monomer ID 314319BDBM314319(US9611224, Example 47ll | (S)-2-Methylamino-N-[(S)...)
Affinity DataIC50: 1.78E+3nMAssay Description:The peptide AVPIAQKSEK-(ε-biotin)-OH (SEQ ID NO: 1) 1:2 TFA (Peptide A) was identified as a substrate for the TR-FRET assay by screening the 6× ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2019
Entry Details
US Patent

TargetBaculoviral IAP repeat-containing protein 3(Human)
Hoffmann-La Roche

US Patent
LigandChemical structure of BindingDB Monomer ID 314319BDBM314319(US9611224, Example 47ll | (S)-2-Methylamino-N-[(S)...)
Affinity DataIC50: 5.76E+4nMAssay Description:The peptide AVPIAQKSEK-(ε-biotin)-OH (SEQ ID NO: 1) 1:2 TFA (Peptide A) was identified as a substrate for the TR-FRET assay by screening the 6× ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/29/2019
Entry Details
US Patent