BDBM50542876 CHEMBL4647174::US20230414581, Compound 3

SMILES Cn1c(=O)sn(-c2cccc3ccccc23)c1=O

InChI Key InChIKey=KRANLBCLPYGQGW-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:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50542876   

TargetSortase family protein(Staphylococcus aureus)
Guizhou University

Curated by ChEMBL
LigandPNGBDBM50542876(CHEMBL4647174 | US20230414581, Compound 3)
Affinity DataIC50: 8.00E+3nMAssay Description:Inhibition of Staphylococcus aureus SrtA delta N24 mutant expressed in Escherichia coli BL21 (DE3) assessed as reduction in IsdA (64 to 323 residues)...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2021
Entry Details Article
PubMed
TargetSortase family protein(Staphylococcus aureus)
Guizhou University

Curated by ChEMBL
LigandPNGBDBM50542876(CHEMBL4647174 | US20230414581, Compound 3)
Affinity DataIC50: 800nMAssay Description:Inhibition of Staphylococcus aureus SrtA delta N24 mutant expressed in Escherichia coli BL21 (DE3) using Abz-LPATG-Dnp substrate incubated for 20 min...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/13/2021
Entry Details Article
PubMed
TargetNAD(+) hydrolase SARM1(Human)
Artivila Biopharma

US Patent
LigandPNGBDBM50542876(CHEMBL4647174 | US20230414581, Compound 3)
Affinity DataIC50: 1.00E+3nMAssay Description:First, 200 μM of the compound was added to a 50 mM Tris-HCl (pH 7.5) solution containing 0.05 μg/ml dN-SARM1. Then half of the mixture was ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2024
Entry Details
Go to US Patent