BDBM50484482 CHEMBL1929017::acs.jmedchem.1c00409_ST.380::med.21724, Compound 45

SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(C)=O)C(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C=O

InChI Key InChIKey=AEYIBAPLFDNVGD-UHFFFAOYSA-N

Data  5 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 5 hits for monomerid = 50484482   

TargetReplicase polyprotein 1ab(SARS-CoV)
University of Bonn

LigandPNGBDBM50484482(CHEMBL1929017 | med.21724, Compound 45 | acs.jmedc...)
Affinity DataIC50: 98nMAssay Description:This is a review article.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/7/2020
Entry Details Article
PubMed
TargetReplicase polyprotein 1ab(SARS-CoV)
University of Bonn

LigandPNGBDBM50484482(CHEMBL1929017 | med.21724, Compound 45 | acs.jmedc...)
Affinity DataIC50: 5.70E+3nMAssay Description:This is a review article.More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/7/2020
Entry Details Article
PubMed
TargetChymotrypsin-like protease CTRL-1(Human)
Kyoto Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50484482(CHEMBL1929017 | med.21724, Compound 45 | acs.jmedc...)
Affinity DataIC50: 5.70E+3nMAssay Description:Inhibition of chymotrypsin-like protease R188I mutant using peptide substrate SO1 measured after 60 mins by HPLC analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/29/2020
Entry Details Article
PubMed
TargetChymotrypsin-like protease CTRL-1(Human)
Kyoto Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50484482(CHEMBL1929017 | med.21724, Compound 45 | acs.jmedc...)
Affinity DataIC50: 5.70E+3nMAssay Description:Inhibition of chymotrypsin-like protease R188I mutant using peptide substrate SO1 preincubated for 20 mins before substrate addition and measured aft...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/29/2020
Entry Details Article
PubMed
TargetReplicase polyprotein 1ab(SARS-CoV)
University of Bonn

LigandPNGBDBM50484482(CHEMBL1929017 | med.21724, Compound 45 | acs.jmedc...)
Affinity DataIC50: 5.70E+3nMAssay Description:This is a review article. Please point to the original journal.More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/27/2022
Entry Details Article
PubMed