| Reaction Details |
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 | Report a problem with these data |
| Target | Estrogen receptor [D538G] |
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| Ligand | BDBM263740 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | Estrogen Receptor Coactivator Assay |
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| pH | 7.4±n/a |
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| Temperature | 298.15±n/a K |
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| IC50 | 28.0±n/a nM |
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| Comments | extracted |
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| Citation |  Bouaboula, M; Brollo, M; Certal, V; El-Ahmad, Y; Filoche-Romme, B; Halley, F; McCort, G; Schio, L; Tabart, M; Terrier, C; Thompson, F Substituted 6,7-dihydro-5H-benzo[7]annulene compounds, processes for their preparation and therapeutic uses thereof US Patent US9714221 Publication Date 7/25/2017 |
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| More Info.: | Get all data from this article, Assay Method |
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| Estrogen receptor [D538G] |
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| Name: | Estrogen receptor [D538G] |
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| Synonyms: | ESR | ESR1 | ESR1_HUMAN | Estrogen receptor alpha D538G | NR3A1 |
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| Type: | Enzyme Catalytic Domain |
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| Mol. Mass.: | 66173.42 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P03372[D538G] |
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| Residue: | 595 |
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| Sequence: | MTMTLHTKASGMALLHQIQGNELEPLNRPQLKIPLERPLGEVYLDSSKPAVYNYPEGAAY
EFNAAAAANAQVYGQTGLPYGPGSEAAAFGSNGLGGFPPLNSVSPSPLMLLHPPPQLSPF
LQPHGQQVPYYLENEPSGYTVREAGPPAFYRPNSDNRRQGGRERLASTNDKGSMAMESAK
ETRYCAVCNDYASGYHYGVWSCEGCKAFFKRSIQGHNDYMCPATNQCTIDKNRRKSCQAC
RLRKCYEVGMMKGGIRKDRRGGRMLKHKRQRDDGEGRGEVGSAGDMRAANLWPSPLMIKR
SKKNSLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINW
AKRVPGFVDLTLHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEG
MVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLD
KITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPLYGLL
LEMLDAHRLHAPTSRGGASVEETDQSHLATAGSTSSHSLQKYYITGEAEGFPATV
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| BDBM263740 |
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| n/a |
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| Name | BDBM263740 |
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| Synonyms: | 6-(3-ethoxy- phenyl)-5-[4- [(3S)-1-(3- fluoropropyl)- pyrrolidin-3- yl]oxy- phenyl]-8,9- dihydro- 7H- benzo[7]- annulen-2-ol5-[4-[(3S)- 1-(3- fluoropropyl)- pyrrolidin-3- yl]oxy- phenyl]-6-[4- (trifluoro- methoxy)- phenyl]-8,9- dihydro- 7H- benzo[7]- annulen-2-ol5-[4-[(3S)- 1-(3- fluoropropyl)- pyrrolidin-3- yl]oxy- phenyl]-6-(4- methoxy- phenyl)-8,9- dihydro- 7H- benzo[7]- annulen-2-ol | US9714221, Example 74 |
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| Type | Small organic molecule |
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| Emp. Form. | C32H36FNO3 |
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| Mol. Mass. | 501.6315 |
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| SMILES | CCOc1cccc(c1)C1=C(c2ccc(O[C@H]3CCN(CCCF)C3)cc2)c2ccc(O)cc2CCC1 |r,c:10| |
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| Structure | 
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