BDBM50592858 CHEMBL5198559

SMILES NC(=N)Nc1ccc(cc1)C(=O)Nc1ccc2COB(O)c2c1

InChI Key InChIKey=WJTODPUBLZHNPT-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50592858   

TargetReplicase polyprotein 1ab(2019-nCoV)
Heidelberg University

Curated by ChEMBL
LigandPNGBDBM50592858(CHEMBL5198559)
Affinity DataIC50: 1.39E+4nMAssay Description:Inhibition of C-terminal His tagged SARS CoV-2 main protease transfected in Escherichia coli BL21 (DE3) using 2-Abz-Ser-AlaVal-Leu-Gln-Ser-Gly-Tyr(3-...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2023
Entry Details
PubMed
TargetTrypsin(Human)
Heidelberg University

Curated by ChEMBL
LigandPNGBDBM50592858(CHEMBL5198559)
Affinity DataIC50: 6.14E+4nMAssay Description:Inhibition of trypsin (unknown origin) using Boc-Val-Pro-Arg-AMC as substrate assessed as enzymatic cleavage preincubated for 15 mins followed by sub...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2023
Entry Details
PubMed