BDBM50642106 CHEMBL5571383

SMILES N#Cc1ccccc1CN1CCCN(C(=O)c2cncc(Cl)c2)CC1

InChI Key

PDB links: 1 PDB ID matches this monomer.

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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50642106   

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

Curated by ChEMBL
LigandPNGBDBM50642106(CHEMBL5571383)
Affinity DataIC50: 2.42E+4nMAssay 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
TargetReplicase polyprotein 1ab(2019-nCoV)
Johannes Gutenberg University

Curated by ChEMBL
LigandPNGBDBM50642106(CHEMBL5571383)
Affinity DataKd:  4.98E+4nMAssay Description:Binding affinity to N-terminal His6-tagged recombinant SARS-CoV-2 MPro C145A mutant transfected in Escherichia coli BL21 (DE3) by surface plasmon res...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
LigandPNGBDBM50642106(CHEMBL5571383)
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
LigandPNGBDBM50642106(CHEMBL5571383)
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