BDBM649911 US20240043417, Example TABLE 1.1::US20240043417, Example TABLE 1.2

SMILES CCCO[C@@H]1C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C(=O)N[C@@H](C[C@@H]1CCNC1=O)C(=O)c1nc2ccccc2s1

InChI Key InChIKey=RJIFGGXDIMKLLL-UHFFFAOYSA-N

Data  2 IC50  2 EC50

  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 4 hits for monomerid = 649911   

TargetReplicase polyprotein 1ab(2019-nCoV)
Purdue Research Foundation

US Patent
LigandPNGBDBM649911(US20240043417, Example TABLE 1.1 | US20240043417, ...)
Affinity DataIC50: 2.55E+3nMAssay Description:IC50 values were determined for compounds that inhibit SARS-CoV-2 3CLpro using our recently described assay (Hattori et al. Nat. Commun. 2021, 12, 66...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2024
Entry Details
Go to US Patent

TargetReplicase polyprotein 1ab(2019-nCoV)
Purdue Research Foundation

US Patent
LigandPNGBDBM649911(US20240043417, Example TABLE 1.1 | US20240043417, ...)
Affinity DataEC50:  2.55E+3nMAssay Description:This patent does not specify.More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2024
Entry Details
Go to US Patent

TargetReplicase polyprotein 1ab(2019-nCoV)
Purdue Research Foundation

US Patent
LigandPNGBDBM649911(US20240043417, Example TABLE 1.1 | US20240043417, ...)
Affinity DataIC50: 2.55E+3nMAssay Description:IC50 values were determined for compounds that inhibit SARS-CoV-2 3CLpro using our recently described assay (Hattori et al. Nat. Commun. 2021, 12, 66...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2024
Entry Details
Go to US Patent

TargetReplicase polyprotein 1ab(2019-nCoV)
Purdue Research Foundation

US Patent
LigandPNGBDBM649911(US20240043417, Example TABLE 1.1 | US20240043417, ...)
Affinity DataEC50:  2.55E+3nMAssay Description:This patent does not specify.More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2024
Entry Details
Go to US Patent