BDBM686914 US20240246951, Compound 245s

SMILES CC1([C@@H]2[C@H]1[C@H](N(C2)C(=O)[C@H](C(C)(C)C)NC(=O)C(F)(F)F)C(=S)N[C@@H](C[C@@H]3CCNC3=O)C(=O)c4nc5c(cccc5s4)F)C

InChI Key InChIKey=GDKLDALGJZVEKT-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 686914   

TargetReplicase polyprotein 1a(2019-nCoV)
National Center For Global Health And Medicine

US Patent
LigandPNGBDBM686914(US20240246951, Compound 245s)
Affinity DataIC50: 300nMAssay Description:The Mpro/3CL protease enzyme inhibitory activity of each of the above compounds (test compounds) was evaluated using an assay kit based on FRET (prod...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/7/2024
Entry Details
Go to US Patent

TargetReplicase polyprotein 1ab(2019-nCoV)
Tokyo Medical and Dental University (TMDU)

Curated by ChEMBL
LigandPNGBDBM686914(US20240246951, Compound 245s)
Affinity DataIC50: 88nMAssay Description:Inhibition of untagged SARS-CoV-2 JPN/TY/WK-521 Main protease using FRET-based UIVT3 as substrate by continuous fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2024
Entry Details
PubMed