BDBM559813 WO2022129953, Example 12

SMILES C[C@@H](CC(=O)N[C@@H](CC(C)(C)C)C(=O)NC(C[C@@H]1CCNC1=O)C(=O)C(=O)NC1CC1)c1ccccc1

InChI Key InChIKey=PHUBLWDKKYDFGK-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 559813   

TargetReplicase polyprotein 1ab(2019-nCoV)
Heptares Therapeutics

WIPO
LigandPNGBDBM559813(WO2022129953, Example 12)
Affinity DataIC50: 16nMAssay Description:The activity of SARS-Cov-2 Mpro was determined in a Fluorescence Resonance Energy Transfer (FRET)-based enzymatic assay using FRET Substrate Dabcyl-K...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/5/2022
Entry Details
WIPO WO2022129953