BDBM50590411 CHEMBL5182315

SMILES C[C@H](c1cccc2c1cccc2)N(C)Cc3c[nH]c4c3cccc4

InChI Key InChIKey=SKQKRKDBQBKZJK-UHFFFAOYSA-N

Data  2 IC50

PDB links: 2 PDB IDs match 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 4 hits for monomerid = 50590411   

TargetReplicase polyprotein 1ab(2019-nCoV)
University of Arizona

Curated by ChEMBL
LigandPNGBDBM50590411(CHEMBL5182315)
Affinity DataIC50: 670nMAssay Description:Inhibition of C-terminal his-tagged SARS CoV-2 PL protease (1564 to 1876 residues) expressed in Escherichia coli BL21 (DE3) cells using ISG15-AMC as ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
University of Arizona

Curated by ChEMBL
LigandPNGBDBM50590411(CHEMBL5182315)
Affinity DataIC50: 670nMAssay Description:Inhibition of C-terminal His-tagged SARS-CoV-2 PLpro preincubated for 1 hrs followed by substrate addition and measured after 3 hrs by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
University of Arizona

Curated by ChEMBL
LigandPNGBDBM50590411(CHEMBL5182315)
Affinity DataIC50: 670nMAssay Description:Inhibition of C-terminal His-tagged SARS-CoV-2 BetaCoV/Wuhan/WIV04/2019 papain-like protease (1564 to 1876 residues) expressed in Escherichia coli BL...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/22/2023
Entry Details Article
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
University of Arizona

Curated by ChEMBL
LigandPNGBDBM50590411(CHEMBL5182315)
Affinity DataIC50: 670nMAssay Description:Inhibition of C-terminal His-tagged SARS-CoV-2 PLpro BetaCoV/Wuhan/WIV04/2019 strain (1564 to 1876 residues) expressed in Escherichia coli BL21(DE3) ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/19/2023
Entry Details
PubMed