BDBM50642109 CHEMBL5574998

SMILES c1ccc(c(c1)CN2CCCN(CC2)C(=O)c3cc(cnc3)Cl)Cl

InChI Key InChIKey=PQQKYBGBGWHEEP-UHFFFAOYSA-N

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50642109   

TargetReplicase polyprotein 1ab(2019-nCoV)
Johannes Gutenberg University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50642109BDBM50642109(CHEMBL5574998)
Affinity DataIC50: 1.30E+3nMAssay Description:Inhibition of N-terminal His6-tagged recombinant SARS-CoV-2 MPro transfected in Escherichia coli BL21 (DE3) using MCA-Ala-Val-Leu-Gln-Ser-Gly-Phe-Arg...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetProcathepsin L(Human)
Johannes Gutenberg University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50642109BDBM50642109(CHEMBL5574998)
Affinity DataIC50: 1.25E+5nMAssay Description:Inhibition of human liver Cathepsin L using Z-Phe-Arg7-amido-4-methylcoumarin hydrochloride as substrate by FRET assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Johannes Gutenberg University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50642109BDBM50642109(CHEMBL5574998)
Affinity DataIC50: 1.25E+5nMAssay Description:Inhibition of N-terminal His6-tagged recombinant SARS-CoV-2 MPro transfected in Escherichia coli BL21 (DE3) assessed as inhibition of MCA quenching u...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed