BDBM50537354 CHEMBL4552935

SMILES COc1cc(\C=C2\SC(=S)N(CC(=O)c3ccccc3)C2=O)cc(OC)c1OC

InChI Key InChIKey=IBBHJVAXOWNKEK-UHFFFAOYSA-N

Data  3 IC50

  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 = 50537354   

TargetEnoyl-[acyl-carrier-protein] reductase [NADH](Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Nanjing University

Curated by ChEMBL
LigandPNGBDBM50537354(CHEMBL4552935)
Affinity DataIC50: 3.12E+3nMAssay Description:Inhibition of recombinant Mycobacterium tuberculosis InhA expressed in Escherichia coli Rosette(DE3) pLysS using trans-2-decenoyl-N-acetylcysteamine ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/2/2021
Entry Details Article
PubMed
Target3-oxoacyl-[acyl-carrier-protein] synthase 3(Escherichia coli)
Nanjing University

Curated by ChEMBL
LigandPNGBDBM50537354(CHEMBL4552935)
Affinity DataIC50: 7.80E+5nMAssay Description:Inhibition of Escherichia coli KAS3 expressed in Escherichia coli BL21(DE3)More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/2/2021
Entry Details Article
PubMed
TargetDNA gyrase A/A/B/B tetramer(Escherichia coli (strain K12))
Nanjing University

Curated by ChEMBL
LigandPNGBDBM50537354(CHEMBL4552935)
Affinity DataIC50: 1.00E+6nMAssay Description:Inhibition of Escherichia coli DNA gyrase assessed as reduction in enzyme-mediated supercoiling of relaxed pBR322 DNA measured after 60 mins by elect...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/2/2021
Entry Details Article
PubMed