BDBM50218560 CHEBI:34857::MOXESTROL::Metoxiestrol::Moxestrol::R-2858

SMILES [H][C@@]12CC[C@@](O)(C#C)[C@@]1(C)C[C@H](OC)[C@]1([H])c3ccc(O)cc3CC[C@@]21[H]

InChI Key InChIKey=MTMZZIPTQITGCY-OLGWUGKESA-N

Data  2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50218560   

TargetEstrogen receptor beta(Homo sapiens (Human))
Novo Nordisk A/S

Curated by ChEMBL
LigandPNGBDBM50218560(CHEBI:34857 | MOXESTROL | Metoxiestrol | Moxestrol...)
Show SMILES CO[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCc3cc(O)ccc3[C@@H]12
Show InChI InChI=1S/C21H26O3/c1-4-21(23)10-9-17-16-7-5-13-11-14(22)6-8-15(13)19(16)18(24-3)12-20(17,21)2/h1,6,8,11,16-19,22-23H,5,7,9-10,12H2,2-3H3/t16-,17-,18-,19+,20-,21-/m0/s1
Affinity DataIC50: 2.90nMAssay Description:Displacement of [3H]17-beta-estradiol from Estrogen receptor of rabbit uterine tissueMore data for this Ligand-Target Pair
TargetEstrogen receptor beta(Homo sapiens (Human))
Novo Nordisk A/S

Curated by ChEMBL
LigandPNGBDBM50218560(CHEBI:34857 | MOXESTROL | Metoxiestrol | Moxestrol...)
Show SMILES CO[C@H]1C[C@@]2(C)[C@@H](CC[C@@]2(O)C#C)[C@@H]2CCc3cc(O)ccc3[C@@H]12
Show InChI InChI=1S/C21H26O3/c1-4-21(23)10-9-17-16-7-5-13-11-14(22)6-8-15(13)19(16)18(24-3)12-20(17,21)2/h1,6,8,11,16-19,22-23H,5,7,9-10,12H2,2-3H3/t16-,17-,18-,19+,20-,21-/m0/s1
Affinity DataIC50: 2.5nMAssay Description:Binding affinity for estrogen receptor of rabbit uterine skeletal muscle tissueMore data for this Ligand-Target Pair