BDBM613581 US11731944, Example 13a

SMILES Cn1ccc(cc1=O)[C@@](C)(N(C(=O)[C@H](F)Cl)c1ccc(OC(F)(F)F)cc1)C(=O)NC1CCC(F)(F)CC1

InChI Key InChIKey=YXGBVVPIFKZTCW-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 613581   

TargetReplicase polyprotein 1a(2019-nCoV)
Insilico Medicine Ip

US Patent
LigandPNGBDBM613581(US11731944, Example 13a)
Affinity DataIC50: 1.00E+4nMAssay Description:The C-His6-tagged SARS-CoV-2 MPRO (NC_045512) was cloned, expressed in E. coli, and purified by WuXi. The substrate of Dabcyl-KTSAVLQIISGFRKME-(Edans...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/26/2023
Entry Details
US Patent