BDBM50187243 17-ethinyl-3,17-estradiol::17-ethinyl-3,17-oestradiol::17-ethinylestradiol::17alpha-Ethinyl estradiol::17alpha-ethynylestra-1,3,5(10)-triene-3,17beta-diol::17alpha-ethynylestradiol::CHEMBL691::ETHINYL ESTRADIOL::Ethinylestradiol::Ethynyl estradiol::ethinyloestradiol

SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@]2(O)C#C

InChI Key InChIKey=BFPYWIDHMRZLRN-SLHNCBLASA-N

Data  9 KI  18 IC50  3 Kd  9 EC50

PDB links: 3 PDB IDs match 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
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50187243   

TargetEstrogen receptor(Homo sapiens (Human))
Marquette University

Curated by ChEMBL
LigandPNGBDBM50187243(17-ethinyl-3,17-estradiol | 17-ethinyl-3,17-oestra...)
Affinity DataEC50:  0.300nMAssay Description:Agonist activity at full length human ERalpha receptor assessed as transcriptional activity incubated for 22 to 24 hrs by cell based luciferase repor...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetEstrogen receptor(Homo sapiens (Human))
Marquette University

Curated by ChEMBL
LigandPNGBDBM50187243(17-ethinyl-3,17-estradiol | 17-ethinyl-3,17-oestra...)
Affinity DataEC50: >50nMAssay Description:Antagonist activity at full length human ERalpha receptor assessed as inhibition of estradiol-induced activation incubated for 22 to 24 hrs by cell b...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetEstrogen receptor(Homo sapiens (Human))
Marquette University

Curated by ChEMBL
LigandPNGBDBM50187243(17-ethinyl-3,17-estradiol | 17-ethinyl-3,17-oestra...)
Affinity DataIC50:  2nMAssay Description:Binding affinity to ERalphaMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed