BDBM645360 Multicaulisin::US20240016777, Table1d.1

SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]-[#6]-1=[#6]-[#6@H](-[#6@@H](-[#6@H](-[#6]-1)-c1ccc(-[#8])cc1-[#8])-[#6](=O)-c1ccc(-[#8])cc1-[#8])-c1c(-[#8])cc2oc(cc(=O)c2c1-[#8])-c1ccc(-[#8])cc1-[#8]

InChI Key InChIKey=MACRTCILBAYZTI-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 645360   

TargetReplicase polyprotein 1a(2019-nCoV)
Beth Israel Deaconess Medical Center

US Patent
LigandPNGBDBM645360(US20240016777, Table1d.1 | Multicaulisin)
Affinity DataIC50: 1.70E+4nMAssay Description:Assay details: A SARS-Cov-2 Mpro construct was prepared, which includes a His-tag and PreScission cleavage site (see FIG. 3A). The construct was tran...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/12/2024
Entry Details
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