BDBM559830 WO2022129953, Example 29

SMILES O=C(N[C@@H](CC1CC1)C(=O)NC(C[C@@H]1CCNC1=O)C(=O)C(=O)NC1CC1)OCc1ccccc1

InChI Key InChIKey=QHSUHKCGVDHTMR-UHFFFAOYSA-N

Data  1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 559830   

TargetReplicase polyprotein 1ab(2019-nCoV)
Heptares Therapeutics

WIPO
LigandPNGBDBM559830(WO2022129953, Example 29)
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