BDBM676280 US20240166598, Compound XR8-106

SMILES C[C@@H](NC(=O)c1cc(N)ccc1C)c1cccc(c1)-c1ccc(CNC2CC[C@@H](O)C2)s1

InChI Key InChIKey=JBSVMHQPYPWXOR-UHFFFAOYSA-N

Data  1 IC50  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 676280   

TargetReplicase polyprotein 1a [1564-1878](Severe acute respiratory syndrome coronavirus (SAR...)
University of Arizona

US Patent
LigandChemical structure of BindingDB Monomer ID 676280BDBM676280(US20240166598, Compound XR8-106)
Affinity DataIC50: 1.40E+3nMAssay Description:The His-tagged SARS-CoV-2 PLpro enzyme was initially prepared in phosphate buffer and diluted to 50 pg/mL with 10 mM sodium acetate (pH 5.5) and immo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/26/2024
Entry Details
US Patent

TargetReplicase polyprotein 1a [1564-1878](Severe acute respiratory syndrome coronavirus (SAR...)
University of Arizona

US Patent
LigandChemical structure of BindingDB Monomer ID 676280BDBM676280(US20240166598, Compound XR8-106)
Affinity DataKd:  2.20E+3nMAssay Description:The His-tagged SARS-CoV-2 PLpro enzyme was initially prepared in phosphate buffer and diluted to 50 pg/mL with 10 mM sodium acetate (pH 5.5) and immo...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/26/2024
Entry Details
US Patent