Target
Estrogen receptor
Ligand
BDBM50161608
Substrate
n/a
Meas. Tech.
ChEMBL_310478 (CHEMBL834422)
EC50
21±n/a nM
Citation
 Hamann, LGMeyer, JHRuppar, DAMarschke, KBLopez, FJAllegretto, EAKaranewsky, DS Structure-activity relationships and sub-type selectivity in an oxabicyclic estrogen receptor alpha/beta agonist scaffold. Bioorg Med Chem Lett 15:1463-6 (2005) [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:
BDBM50161608
Synonyms:
(1R,4R,5R)-4-(2-Chloro-4-hydroxy-phenyl)-6,8,8-trimethyl-3-oxa-bicyclo[3.3.1]non-6-en-1-ol | CHEMBL178908
Type:
Small organic molecule
Emp. Form.:
C17H21ClO3
Mol. Mass.:
308.8
SMILES:
CC1=CC(C)(C)[C@@]2(O)CO[C@H]([C@@H]1C2)c1ccc(O)cc1Cl |t:1|
Structure:
Search PDB for entries with ligand similarity: