BDBM420296 Advanced SARS-CoV-2 Inhibitor 11a::MPI10::acs.jmedchem.1c00409_ST.40::med.21724, Compound 61::peptidomimetic aldehydes 11a::peptidomimetic coronavirus 3CLpro inhibitors 11a

SMILES O=C[C@H](C[C@@H]1CCNC1=O)NC(=O)[C@H](CC1CCCCC1)NC(=O)c1cc2ccccc2[nH]1

InChI Key InChIKey=HPKJGHVHQWJOOT-ZJOUEHCJSA-N

Data  1 KI  15 IC50  5 EC50

PDB links: 3 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 420296   

TargetCathepsin B(Homo sapiens (Human))
The University of Arizona

LigandBDBM420296(Advanced SARS-CoV-2 Inhibitor 11a | MPI10 | acs.jm...)Copy SMILESCopy InChI

Affinity DataIC50:  0.210nMAssay Description:FRET-based enzymatic assay.More data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProt
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchasePDB

In DepthDetails ArticlePubMed
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