BDBM263691 6- (benzofuran- 5-yl)-5- [4-[(3S)-1- (3- fluoropropyl)- pyrrolidin-3- yl]oxy- phenyl]-8,9- dihydro- 7H- benzo[7]- annulen-2-ol6-(2-fluoro- 4- methoxy- phenyl)-5- [4-[(3S)-1- (3- fluoropropyl)- pyrrolidin-3- yl]oxy- phenyl]-8,9- dihydro- 7H- benzo[7]- annulen-2-ol::US9714221, Example 28
SMILES: Oc1ccc2c(CCCC(c3ccc4occc4c3)=C2c2ccc(O[C@H]3CCN(CCCF)C3)cc2)c1
InChI Key: InChIKey=RZAURWDDKRVTEZ-NDEPHWFRSA-N
Data: 3 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Estrogen receptor (Homo sapiens (Human)) | BDBM263691![]() (6- (benzofuran- 5-yl)-5- [4-[(3S)-1- (3- fluoropro...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | US Patent | n/a | n/a | 2 | n/a | n/a | n/a | n/a | 7.4 | 25 |
SANOFI US Patent | Assay Description It is a competition assay, where binding of a test compound to a complex comprised of (i) His6-ERα298-554 protein representing ERα ligand-b... | US Patent US9714221 (2017) BindingDB Entry DOI: 10.7270/Q2N58PB1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Estrogen receptor alpha Y537S (Homo sapiens (Human)) | BDBM263691![]() (6- (benzofuran- 5-yl)-5- [4-[(3S)-1- (3- fluoropro...) | PDB GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | US Patent | n/a | n/a | 4 | n/a | n/a | n/a | n/a | 7.4 | 25 |
SANOFI US Patent | Assay Description It is a competition assay, where binding of a test compound to a complex comprised of (i) His6-ERα298-554 protein representing ERα ligand-b... | US Patent US9714221 (2017) BindingDB Entry DOI: 10.7270/Q2N58PB1 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Estrogen receptor alpha D538G (Homo sapiens (Human)) | BDBM263691![]() (6- (benzofuran- 5-yl)-5- [4-[(3S)-1- (3- fluoropro...) | PDB GoogleScholar AffyNet ![]() | PC cid PC sid UniChem | US Patent | n/a | n/a | 5 | n/a | n/a | n/a | n/a | 7.4 | 25 |
SANOFI US Patent | Assay Description It is a competition assay, where binding of a test compound to a complex comprised of (i) His6-ERα298-554 protein representing ERα ligand-b... | US Patent US9714221 (2017) BindingDB Entry DOI: 10.7270/Q2N58PB1 | |||||||||||
More data for this Ligand-Target Pair |