Reaction Details |
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Target | Estrogen receptor |
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Ligand | BDBM50323701 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_649073 (CHEMBL1218771) |
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EC50 | 275±n/a nM |
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Citation | Renner, S; van Otterlo, WA; Dominguez Seoane, M; Möcklinghoff, S; Hofmann, B; Wetzel, S; Schuffenhauer, A; Ertl, P; Oprea, TI; Steinhilber, D; Brunsveld, L; Rauh, D; Waldmann, H Bioactivity-guided mapping and navigation of chemical space. Nat Chem Biol5:585-92 (2009) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Estrogen receptor |
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Name: | Estrogen receptor |
Synonyms: | ER | ER-alpha | ESR | ESR1 | ESR1_HUMAN | Estradiol receptor | Estrogen receptor | Estrogen receptor (ER alpha) | Estrogen receptor (ER-alpha) | Estrogen receptor alpha (ER alpha) | Estrogen receptor alpha (ER) | NR3A1 | Nuclear receptor subfamily 3 group A member 1 |
Type: | Protein |
Mol. Mass.: | 66230.44 |
Organism: | Homo sapiens (Human) |
Description: | P03372 |
Residue: | 595 |
Sequence: | MTMTLHTKASGMALLHQIQGNELEPLNRPQLKIPLERPLGEVYLDSSKPAVYNYPEGAAY
EFNAAAAANAQVYGQTGLPYGPGSEAAAFGSNGLGGFPPLNSVSPSPLMLLHPPPQLSPF
LQPHGQQVPYYLENEPSGYTVREAGPPAFYRPNSDNRRQGGRERLASTNDKGSMAMESAK
ETRYCAVCNDYASGYHYGVWSCEGCKAFFKRSIQGHNDYMCPATNQCTIDKNRRKSCQAC
RLRKCYEVGMMKGGIRKDRRGGRMLKHKRQRDDGEGRGEVGSAGDMRAANLWPSPLMIKR
SKKNSLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINW
AKRVPGFVDLTLHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEG
MVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLD
KITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPLYDLL
LEMLDAHRLHAPTSRGGASVEETDQSHLATAGSTSSHSLQKYYITGEAEGFPATV
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BDBM50323701 |
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n/a |
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Name | BDBM50323701 |
Synonyms: | 2-(Trifluoroacetyl)-1,2,3,4-tetrahydro-6-isoquinolinol | CHEMBL1213617 |
Type | Small organic molecule |
Emp. Form. | C11H10F3NO2 |
Mol. Mass. | 245.1978 |
SMILES | Oc1ccc2CN(CCc2c1)C(=O)C(F)(F)F |
Structure |
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