BDBM50096873 (3aR,5S,8aR,9aR)-5,8a-dimethyl-3-methylidene-3a,5,6,7,8,8a,9,9a-octahydronaphtho[2,3-b]furan-2(3H)-one::Alantolactone::CHEMBL136356

SMILES C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)C(=C)[C@H]3C=C12

InChI Key InChIKey=PXOYOCNNSUAQNS-UHFFFAOYSA-N

Data  5 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 5 hits for monomerid = 50096873   

TargetUDP-N-acetylglucosamine 1-carboxyvinyltransferase(Pseudomonas aeruginosa (strain ATCC 15692 / PAO1 /...)
Saarland University

Curated by ChEMBL
LigandPNGBDBM50096873((3aR,5S,8aR,9aR)-5,8a-dimethyl-3-methylidene-3a,5,...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of Pseudomonas aeruginosa PAO1293 MurA in presence of UNAGMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetUDP-N-acetylglucosamine 1-carboxyvinyltransferase(Escherichia coli (strain K12))
Saarland University

Curated by ChEMBL
LigandPNGBDBM50096873((3aR,5S,8aR,9aR)-5,8a-dimethyl-3-methylidene-3a,5,...)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of Escherichia coli K12 Mur A in presence of UNAGMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/9/2012
Entry Details Article
PubMed
TargetTranscriptional activator Myb(Chicken)
University of M£Nster

Curated by ChEMBL
LigandPNGBDBM50096873((3aR,5S,8aR,9aR)-5,8a-dimethyl-3-methylidene-3a,5,...)
Affinity DataIC50: 2.37E+4nMAssay Description:Inhibition of c-Myb-induced mim-1 gene expression in doxycyclin-treated chicken HD11 cells after 24 hrs by GFP assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2014
Entry Details Article
PubMed
TargetTranscriptional activator Myb(Chicken)
University of M£Nster

Curated by ChEMBL
LigandPNGBDBM50096873((3aR,5S,8aR,9aR)-5,8a-dimethyl-3-methylidene-3a,5,...)
Affinity DataIC50: 2.36E+4nMAssay Description:Inhibition of c-Myb-induced mim-1 gene expression in doxycyclin-treated chicken HD11 cells after 24 hrs by GFP assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/12/2014
Entry Details Article
PubMed
TargetPoly [ADP-ribose] polymerase 1(Human)
Shanghai Jiao Tong University

Curated by ChEMBL
LigandPNGBDBM50096873((3aR,5S,8aR,9aR)-5,8a-dimethyl-3-methylidene-3a,5,...)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant PARP1 in presence of NAD+ by ELISAMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2023
Entry Details
PubMed