BDBM649914 US20240043417, Example TABLE 1.4

SMILES CCCO[C@@H]1C[C@H](N(C1)C(=O)C(NC(=O)NC(C)(C)C)C(C)C)C(=O)N[C@@H](CC1CCNC1=O)C(=O)c1nc2ccccc2s1

InChI Key InChIKey=DHHXXZOWKWQRPM-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  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 2 hits for monomerid = 649914   

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

US Patent
LigandPNGBDBM649914(US20240043417, Example TABLE 1.4)
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
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TargetReplicase polyprotein 1ab(2019-nCoV)
Purdue Research Foundation

US Patent
LigandPNGBDBM649914(US20240043417, Example TABLE 1.4)
Affinity DataEC50:  7.50E+4nMAssay 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