BDBM429456 US20240083885, Compound Jun9-17-2::acs.jmedchem.1c00409_ST.375::med.21724, Compound 128

SMILES CC(C)(C)NC(=O)C(N(C(=O)c1ccco1)c1ccc(cc1)C(C)(C)C)c1cnccn1

InChI Key InChIKey=WLZURSBQLFFPCE-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 429456   

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

LigandPNGBDBM429456(med.21724, Compound 128 | acs.jmedchem.1c00409_ST....)
Affinity DataIC50: 5.20E+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
TargetReplicase polyprotein 1ab(SARS-CoV)
University of Bonn

LigandPNGBDBM429456(med.21724, Compound 128 | acs.jmedchem.1c00409_ST....)
Affinity DataIC50: 5.50E+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
TargetReplicase polyprotein 1ab(2019-nCoV)
The University of Arizona

Curated by ChEMBL
LigandPNGBDBM429456(med.21724, Compound 128 | acs.jmedchem.1c00409_ST....)
Affinity DataIC50: 4.93E+3nMAssay Description:Non-covalent inhibition of SARS-Cov-2 -Mpro incubated for 30 mins using FRET substrate measured for 1 hr by FRET-based enzymatic assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/24/2023
Entry Details
PubMed
TargetReplicase polyprotein 1a(2019-nCoV)
Arizona Board Of Regents On Behalf Of The University Of Arizona

US Patent
LigandPNGBDBM429456(med.21724, Compound 128 | acs.jmedchem.1c00409_ST....)
Affinity DataIC50: 4.93nMAssay Description:The main protease (Mpro) enzymatic assays were carried out exact as previously described in pH 6.5 reaction buffer containing 20 mM HEPES pH 6.5, 120...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2024
Entry Details
Go to US Patent