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TargetEstrogen receptor
LigandBDBM50398933
Substrate/Competitorn/a
Meas. Tech.ChEMBL_874806 (CHEMBL2188850)
EC50 60±n/a nM
Citation Schäfer, AWellner, AStrauss, MSchäfer, AWolber, GGust, R Influence of chlorine or fluorine substitution on the estrogenic properties of 1-alkyl-2,3,5-tris(4-hydroxyphenyl)-1H-pyrroles. J Med Chem55:9607-18 (2012) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Estrogen receptor
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
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50398933
n/a
NameBDBM50398933
Synonyms:CHEMBL2178796
TypeSmall organic molecule
Emp. Form.C23H18FNO3
Mol. Mass.375.3923
SMILESCn1c(cc(c1-c1ccc(O)cc1F)-c1ccc(O)cc1)-c1ccc(O)cc1 |(23.78,-8.43,;23.45,-6.92,;22.04,-6.3,;22.2,-4.77,;23.7,-4.44,;24.48,-5.77,;26,-5.93,;26.9,-4.68,;28.43,-4.83,;29.07,-6.24,;30.6,-6.4,;28.17,-7.49,;26.63,-7.34,;25.73,-8.58,;24.32,-3.04,;25.86,-2.88,;26.48,-1.47,;25.57,-.23,;26.19,1.2,;24.03,-.4,;23.41,-1.81,;20.71,-7.08,;19.37,-6.31,;18.04,-7.09,;18.04,-8.63,;16.7,-9.4,;19.37,-9.4,;20.71,-8.63,)|
Structure
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