BDBM50627843 CHEMBL5288416

SMILES [H][C@]12CN([C@H](C(=O)N[C@@H](C[C@@H]3CCNC3=O)C=O)[C@@]1([H])C2(C)C)C(=O)COc1ccc(Cl)cc1Cl

InChI Key InChIKey=BDFIPRXCQILSGM-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50627843   

TargetReplicase polyprotein 1ab(2019-nCoV)
Shaanxi University of Science & Technology

Curated by ChEMBL
LigandPNGBDBM50627843(CHEMBL5288416)
Affinity DataIC50: 10nMAssay Description:Inhibition of recombinant SARS-CoV-2 3CLp using fluorogenic substrate by microplate readerMore data for this Ligand-Target Pair
In Depth
Date in BDB:
10/11/2025
Entry Details
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Shaanxi University of Science & Technology

Curated by ChEMBL
LigandPNGBDBM50627843(CHEMBL5288416)
Affinity DataIC50: 28nMAssay Description:Inhibition of His/SUMO tagged SARS-CoV-2 main protease transfected in Escherichia coli BL21 (DE3) using Dabcyl-KTSAVLQSGFRKME-Edans as substrate prei...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2024
Entry Details
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Shaanxi University of Science & Technology

Curated by ChEMBL
LigandPNGBDBM50627843(CHEMBL5288416)
Affinity DataEC50:  280nMAssay Description:Inhibition of eGFP-fused SARS-CoV-2 main protease transfected in HEK293T/17 cells incubated for 3 days by flow cytometry analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/19/2024
Entry Details
PubMed