BDBM50435400 CHEMBL99313::acs.jmedchem.1c00409_ST.173

SMILES O=c1n(Cc2ccccc2)sc2ccccc12

InChI Key InChIKey=GTTHESNNWLOVLD-UHFFFAOYSA-N

Data  3 IC50

  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 3 hits for monomerid = 50435400   

TargetCaspase-3(Human)
Nankai University

Curated by ChEMBL
LigandPNGBDBM50435400(CHEMBL99313 | acs.jmedchem.1c00409_ST.173)
Affinity DataIC50: 1.08E+4nMAssay Description:Inhibition of recombinant human caspase-3 using Ac-LDEVD-AMC as substrate assessed as accumulation of 7-AMC incubated for 10 mins followed by substra...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2014
Entry Details Article
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Michigan State University

LigandPNGBDBM50435400(CHEMBL99313 | acs.jmedchem.1c00409_ST.173)
Affinity DataIC50: 170nMAssay Description:This is a review article. Please point to the original journal.More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/27/2022
Entry Details Article
PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Michigan State University

LigandPNGBDBM50435400(CHEMBL99313 | acs.jmedchem.1c00409_ST.173)
Affinity DataIC50: 190nMAssay Description:Inhibition of SARS-CoV-2 Main protease by FRET assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed