BDBM50663892 CHEMBL6144926

SMILES C=C1NC(=O)[C@]2(C)CSC(=N2)c2csc(n2)[C@]2(C)CSC(=N2)[C@@H]([C@@H](C)CC)NC(=O)[C@@H](C)NC(=O)/C(=CC(C)C)COC(=O)c2csc(n2)[C@H](C(C)C)N(C)C(=O)[C@H](COC)NC1=O

InChI Key InChIKey=YRDRGFIMQLUSGJ-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 = 50663892   

TargetReplicase polyprotein 1ab(HCoV-229E)
Jilin University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50663892BDBM50663892(CHEMBL6144926)
Affinity DataIC50: 2.39E+3nMAssay Description:Inhibition of HCov-229E 3CLpro by FRET assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMed