null

SMILES CC\C(=C/C=C1/C[C@@H](O)C[C@H](O)C1=C)c1cccc(CCCCCC(C)(C)O)c1

InChI Key InChIKey=BQVXPWDQMUNMLU-FIKMVKLPSA-N

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50455853   

TargetVitamin D3 receptor(Homo sapiens (Human))
University of Santiago de Compostela

Curated by ChEMBL
LigandPNGBDBM50455853(CHEMBL4202828)copy SMILEScopy InChI
Affinity DataEC50:  5.60nMAssay Description:Agonist activity at VDR in human MCF7 cells assessed as increase in transcription of CYP24A1 gene after 24 hrs by luciferase reporter gene assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q22R3V8WPubMed
TargetVitamin D3 receptor(Homo sapiens (Human))
University of Santiago de Compostela

Curated by ChEMBL
LigandPNGBDBM50455853(CHEMBL4202828)copy SMILEScopy InChI
Affinity DataIC50: 4.5nMAssay Description:Displacement of fluormone from human full length VDR after 2 hrs by fluorescence polarization assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q22R3V8WPubMed