BDBM667053 1089::US20240116946, Example 1088::US20240116946, Example 1089

SMILES COc1cnc(Cl)c(c1)-c1cc2n(CCC#N)c(=O)n(-c3cncc4ccccc34)c(=O)c2s1

InChI Key InChIKey=NJLRWVRDFVGBOT-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 667053   

TargetReplicase polyprotein 1a(2019-nCoV)
Gilead Sciences

US Patent
LigandPNGBDBM667053(US20240116946, Example 1088 | 1089 | US20240116946...)
Affinity DataIC50: 1.65nMAssay Description:This biochemical assay measured small molecule inhibitor IC50 values against recombinant SARS-CoV-2 Main protease (Mpro). Compounds from 100 μM ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/29/2024
Entry Details
Go to US Patent

TargetReplicase polyprotein 1a(2019-nCoV)
Gilead Sciences

US Patent
LigandPNGBDBM667053(US20240116946, Example 1088 | 1089 | US20240116946...)
Affinity DataIC50: 1.00E+3nMAssay Description:This biochemical assay measured small molecule inhibitor IC50 values against recombinant SARS-CoV-2 Main protease (Mpro). Compounds from 100 μM ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/29/2024
Entry Details
Go to US Patent