BDBM429304 CVD-0006354::acs.jmedchem.1c00409_ST.426::indole chloropyridinyl-ester derived, 1::jm5b01461, Compound 124

SMILES Clc1cncc(OC(=O)c2cccc3[nH]ccc23)c1

InChI Key InChIKey=BOSZJNSICHFHMA-UHFFFAOYSA-N

Data  11 IC50  4 EC50

  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 = 429304   

TargetReplicase polyprotein 1ab(2019-nCoV)
Purdue University

LigandPNGBDBM429304(CVD-0006354 | acs.jmedchem.1c00409_ST.426 | indole...)
Affinity DataIC50:  250nMAssay Description:IC50 values were determined for compounds that covalently inhibit SARS-CoV-2 3CLpro using our recently described assay and data fitting methods that ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Purdue University

LigandPNGBDBM429304(CVD-0006354 | acs.jmedchem.1c00409_ST.426 | indole...)
Affinity DataEC50:  2.80E+3nMAssay Description:VeroE6 cells and TMPRSS2-overexpressing VeroE6 (VeroE6TMPRSS2) cells were obtained from the Japanese Collection of Research Bioresource...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed