BDBM94574 MLS002699028::SMR001563150::[(1R,2S,4E,8Z,12S,13S)-12-hydroxy-4,8,12-trimethyl-16-methylidene-15-oxo-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-2-yl] acetate::[(1R,2S,4E,8Z,12S,13S)-4,8,12-trimethyl-16-methylidene-12-oxidanyl-15-oxidanylidene-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-2-yl] ethanoate::acetic acid [(1R,2S,4E,8Z,12S,13S)-12-hydroxy-15-keto-4,8,12-trimethyl-16-methylene-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-2-yl] ester::acetic acid [(1R,2S,4E,8Z,12S,13S)-12-hydroxy-4,8,12-trimethyl-16-methylene-15-oxo-14-oxabicyclo[11.3.1]heptadeca-4,8-dien-2-yl] ester::cid_44825950

SMILES CC(=O)O[C@H]1C\C(C)=C\CC\C(C)=C/CC[C@](C)(O)[C@@H]2C[C@@H]1C(=C)C(=O)O2

InChI Key InChIKey=WMGWWFHPPNGBBT-ACXOONDBSA-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 = 94574   

TargetHepatocyte nuclear factor 4-alpha(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM94574(MLS002699028 | SMR001563150 | [(1R,2S,4E,8Z,12S,13...)
Affinity DataIC50:  3.21E+3nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetPerilipin-5(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM94574(MLS002699028 | SMR001563150 | [(1R,2S,4E,8Z,12S,13...)
Affinity DataIC50:  1.91E+3nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetPerilipin-1(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM94574(MLS002699028 | SMR001563150 | [(1R,2S,4E,8Z,12S,13...)
Affinity DataIC50:  1.87E+3nMMore data for this Ligand-Target Pair
In DepthDetails PCBioAssay