BDBM50634388 CHEMBL5401144

SMILES COC(=O)N[C@H](C(=O)N1CCC2(CC2)C[C@H]1C(=O)N[C@@H](CCC(C)(F)F)C(=O)C(=O)NC1CC1)C(C)(C)C

InChI Key InChIKey=VDPJORBKOLOGMZ-UHFFFAOYSA-N

Data  1 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 3 hits for monomerid = 50634388   

TargetReplicase polyprotein 1a(2019-nCoV)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM50634388(CHEMBL5401144 | US20250223259, Example 29)
Affinity DataIC50: 7.70nMAssay Description:The enzymatic activity of SARS2 coronavirus 3CL protease was determined in a FRET (fluorescence resonance energy transfer)-based assay measuring the ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/26/2025
Entry Details
US Patent

TargetReplicase polyprotein 1ab(2019-nCoV)TBA
LigandPNGBDBM50634388(CHEMBL5401144 | US20250223259, Example 29)
Affinity DataIC50: 7.70nMAssay Description:Inhibition of wild type recombinant SARS-CoV-2 3CLpro (1 to 306 residues) expressed in Escherichia coli (DE3) competent cells using CP488-ESATLQSGLRK...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details

TargetReplicase polyprotein 1ab(2019-nCoV)TBA
LigandPNGBDBM50634388(CHEMBL5401144 | US20250223259, Example 29)
Affinity DataIC50: 7.70nMAssay Description:Inhibition of SARS-CoV-2 3CL protease using SEQ peptide as substrate pre-incubated for 30 min followed by substrate addition measured after 4 hrs by ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/22/2024
Entry Details
PubMed