BDBM442762 MPI6

SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)OC(C)(C)C)C(=O)N[C@@H](C[C@@H]1CCNC1=O)C=O

InChI Key InChIKey=GTBAQTKMASRCMG-UHFFFAOYSA-N

Data  1 KI  3 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 = 442762   

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

Curated by ChEMBL
LigandPNGBDBM442762(MPI6)
Affinity DataIC50: 105nMAssay Description:Inhibition of N-terminal His-SUMO tagged SARS-CoV-2 Main protease transfected in Escherichia coli BL21 (DE3) using DABCYL-Lys-Thr-Ser-Ala-Val-Leu-Gln...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed
TargetProcathepsin L(Human)
University of Palermo

Curated by ChEMBL
LigandPNGBDBM442762(MPI6)
Affinity DataIC50: 1.20nMAssay Description:Inhibition of human Cathepsin L using Z-Phe-Arg-AMC as fluorogenic substrate incubated for 30 mins followed by substrate addition by fluorescence bas...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
University of Palermo

Curated by ChEMBL
LigandPNGBDBM442762(MPI6)
Affinity DataKi:  59nM IC50: 60nMAssay Description:The assays were carried out with 20 nM enzyme (except for MPI3, for which 10 nM enzyme was used) and 10 μM substrate at 37oC with continuous sha...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/31/2021
Entry Details Article
PubMed