BDBM713975 US20250025443, Compound 159::US20250025443, Example 8

SMILES Cc1ccc(OCCN)cc1C(=O)N[C@H](C)c1cccc2ccccc12

InChI Key InChIKey=CMRWLYLCXJHAMP-UHFFFAOYSA-N

  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 2 hits for monomerid = 713975   

TargetReplicase polyprotein 1a(2019-nCoV)
Clear Creek Bio

US Patent
LigandPNGBDBM713975(US20250025443, Compound 159 | US20250025443, Examp...)
Affinity DataIC50: 550nMAssay Description:Test compounds were assayed at 10 concentrations from 10 μM, in duplicate for the IC50 determination. The assay buffer contained 50 mM HEPES (pH 7.5)...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
5/29/2025
Entry Details
US Patent

TargetReplicase polyprotein 1ab(2019-nCoV)
State University of New Jersey

Curated by ChEMBL
LigandPNGBDBM713975(US20250025443, Compound 159 | US20250025443, Examp...)
Affinity DataIC50: 690nMAssay Description:Inhibition of C-terminal His-tagged SARS-CoV-2 BetaCoV/Wuhan/WIV04/2019 PLpro expressed in Escherichia coli BL21 (DE3) cells preincubated for 30 mins...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed