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Target
Estrogen receptor
Ligand
BDBM50255198
Substrate
n/a
Meas. Tech.
ChEMBL_515894 (CHEMBL993948)
EC50
19±n/a nM
Citation
 Minutolo, F; Bertini, S; Granchi, C; Marchitiello, T; Prota, G; Rapposelli, S; Tuccinardi, T; Martinelli, A; Gunther, JR; Carlson, KE; Katzenellenbogen, JA; Macchia, M Structural evolutions of salicylaldoximes as selective agonists for estrogen receptor beta. J Med Chem 52:858-67 (2009) [PubMed]  Article
Target
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:
MTMTLHTKASGMALLHQIQGNELEPLNRPQLKIPLERPLGEVYLDSSKPAVYNYPEGAAYEFNAAAAANAQVYGQTGLPYGPGSEAAAFGSNGLGGFPPLNSVSPSPLMLLHPPPQLSPFLQPHGQQVPYYLENEPSGYTVREAGPPAFYRPNSDNRRQGGRERLASTNDKGSMAMESAKETRYCAVCNDYASGYHYGVWSCEGCKAFFKRSIQGHNDYMCPATNQCTIDKNRRKSCQACRLRKCYEVGMMKGGIRKDRRGGRMLKHKRQRDDGEGRGEVGSAGDMRAANLWPSPLMIKRSKKNSLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTLHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPLYDLLLEMLDAHRLHAPTSRGGASVEETDQSHLATAGSTSSHSLQKYYITGEAEGFPATV
  
Inhibitor
Name:
BDBM50255198
Synonyms:
(E)-3-Chloro-4-(3-fluoro-4-hydroxyphenyl)salicylaldoxime | CHEMBL509051
Type:
Small organic molecule
Emp. Form.:
C13H9ClFNO3
Mol. Mass.:
281.667
SMILES:
Oc1ccc(cc1F)-c1ccc(CN=O)c(O)c1Cl
Structure:
Search PDB for entries with ligand similarity: