BDBM50480493 CHEMBL539209::acs.jmedchem.1c00409_ST.302::jm5b01461, Compound 58

SMILES [H][C@@]1(C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)C(=O)c2nccs2)CCNC1=O

InChI Key InChIKey=NHPGFNNCMAVKMC-UHFFFAOYSA-N

Data  3 KI

  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 3 hits for monomerid = 50480493   

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

LigandPNGBDBM50480493(CHEMBL539209 | jm5b01461, Compound 58 | acs.jmedch...)
Affinity DataKi:  2.20E+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

LigandPNGBDBM50480493(CHEMBL539209 | jm5b01461, Compound 58 | acs.jmedch...)
Affinity DataKi:  2.20E+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(SARS-CoV)
University of Bonn

LigandPNGBDBM50480493(CHEMBL539209 | jm5b01461, Compound 58 | acs.jmedch...)
Affinity DataKi:  2.20E+3nMAssay Description:Inhibition of SARS coronavirus 3CL protease pretreated for 10 mins before substrate additionMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2020
Entry Details Article
PubMed