Reaction Details Report a problem with these data
Target
Estrogen receptor
Ligand
BDBM17292
Substrate
n/a
Meas. Tech.
ChEMBL_1282730 (CHEMBL3102027)
Kd
3.0±n/a nM
Citation
 McCullough, C; Neumann, TS; Gone, JR; He, Z; Herrild, C; Wondergem Nee Lukesh, J; Pandey, RK; Donaldson, WA; Sem, DS Probing the human estrogen receptor-α binding requirements for phenolic mono- and di-hydroxyl compounds: a combined synthesis, binding and docking study. Bioorg Med Chem 22:303-10 (2014) [PubMed]  Article 
Target
Name:
Estrogen receptor
Synonyms:
ER | ER-alpha | Estradiol receptor | Estrogen receptor (ER alpha) | Estrogen receptor (ER-alpha) | Estrogen receptor alpha (ER alpha) | Estrogen receptor alpha (ER) | Nuclear receptor subfamily 3 group A member 1 | Estrogen receptor | ESR1_HUMAN | ESR1 | ESR | NR3A1
Type:
Protein
Mol. Mass.:
66230.44
Organism:
Human
Description:
P03372
Residue:
595
Sequence:
MTMTLHTKASGMALLHQIQGNELEPLNRPQLKIPLERPLGEVYLDSSKPAVYNYPEGAAYEFNAAAAANAQVYGQTGLPYGPGSEAAAFGSNGLGGFPPLNSVSPSPLMLLHPPPQLSPFLQPHGQQVPYYLENEPSGYTVREAGPPAFYRPNSDNRRQGGRERLASTNDKGSMAMESAKETRYCAVCNDYASGYHYGVWSCEGCKAFFKRSIQGHNDYMCPATNQCTIDKNRRKSCQACRLRKCYEVGMMKGGIRKDRRGGRMLKHKRQRDDGEGRGEVGSAGDMRAANLWPSPLMIKRSKKNSLALSLTADQMVSALLDAEPPILYSEYDPTRPFSEASMMGLLTNLADRELVHMINWAKRVPGFVDLTLHDQVHLLECAWLEILMIGLVWRSMEHPGKLLFAPNLLLDRNQGKCVEGMVEIFDMLLATSSRFRMMNLQGEEFVCLKSIILLNSGVYTFLSSTLKSLEEKDHIHRVLDKITDTLIHLMAKAGLTLQQQHQRLAQLLLILSHIRHMSNKGMEHLYSMKCKNVVPLYDLLLEMLDAHRLHAPTSRGGASVEETDQSHLATAGSTSSHSLQKYYITGEAEGFPATV
  
Inhibitor
Name:
BDBM17292
Synonyms:
[2,4,6,7-3H]-17beta-estradiol | [3H]-estradiol | 17 beta-Estradiol | Ovocyclin | (1S,10R,11S,14S,15S)-15-methyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-2,4,6-triene-5,14-diol | 17beta-estradiol (E2) | ESTRADIOL | Estradiol-17 alpha | CHEMBL135 | [3H]]estradiol | [2,4,6,7-3H]-E2 | US9034854, E2 | US9561238, E2 | US9040509, E2 | 17α-ethinylestradiol | CS336 | US9422324, E2
Type:
Steroid
Emp. Form.:
TBD
Mol. Mass.:
TBD
SMILES:
TBD
Structure:
Search PDB for entries with ligand similarity: