BDBM721542 US20250059159, Compound 19::methyl (R,E)-4-(2-(2-(3-methyl-N-(1-(1-(naphthalen-1-yl)ethyl)piperidin-4-yl)butanamido)acetamido)acetamido)but-2-enoate

SMILES COC(=O)/C=C/CNC(=O)CNC(=O)CN(C(=O)CC(C)C)C1CCN([C@H](C)c2cccc3ccccc23)CC1

InChI Key InChIKey=QQAQCBZNMHZOFY-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 721542   

TargetReplicase polyprotein 1ab(2019-nCoV)
Shanghai Synergy Pharmaceutical Sciences

US Patent
LigandPNGBDBM721542(methyl (R,E)-4-(2-(2-(3-methyl-N-(1-(1-(naphthalen...)
Affinity DataIC50: 100nMAssay Description:The PLpro enzyme was purified as described above and prepared in assay buffer (50 mM HEPES, pH 7.5, 0.01% Triton X-100 (v/v), 0.1 mg mL-1 BSA, and 2 ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/19/2025
Entry Details
Go to US Patent