Reaction Details Report a problem with these data
Target
Estrogen receptor beta
Ligand
BDBM50475361
Substrate
n/a
Meas. Tech.
ChEMBL_304015 (CHEMBL840098)
Ki
25±n/a nM
Citation
 Hoekstra, WJ; Patel, HS; Liang, X; Blanc, JB; Heyer, DO; Willson, TM; Iannone, MA; Kadwell, SH; Miller, LA; Pearce, KH; Simmons, CA; Shearin, J Discovery of novel quinoline-based estrogen receptor ligands using peptide interaction profiling. J Med Chem 48:2243-7 (2005) [PubMed]  Article 
Target
Name:
Estrogen receptor beta
Synonyms:
ER-beta | ESR2 | ESR2_HUMAN | ESTRB | Estradiol receptor beta (ERβ) | Estrogen receptor | Estrogen receptor (ER beta) | Estrogen receptor beta | Estrogen receptor beta (ER beta) | Estrogen receptor beta (ER) | NR3A2 | Nuclear receptor subfamily 3 group A member 2 | estrogen beta
Type:
Protein
Mol. Mass.:
59238.43
Organism:
Homo sapiens (Human)
Description:
Q92731
Residue:
530
Sequence:
MDIKNSPSSLNSPSSYNCSQSILPLEHGSIYIPSSYVDSHHEYPAMTFYSPAVMNYSIPSNVTNLEGGPGRQTTSPNVLWPTPGHLSPLVVHRQLSHLYAEPQKSPWCEARSLEHTLPVNRETLKRKVSGNRCASPVTGPGSKRDAHFCAVCSDYASGYHYGVWSCEGCKAFFKRSIQGHNDYICPATNQCTIDKNRRKSCQACRLRKCYEVGMVKCGSRRERCGYRLVRRQRSADEQLHCAGKAKRSGGHAPRVRELLLDALSPEQLVLTLLEAEPPHVLISRPSAPFTEASMMMSLTKLADKELVHMISWAKKIPGFVELSLFDQVRLLESCWMEVLMMGLMWRSIDHPGKLIFAPDLVLDRDEGKCVEGILEIFDMLLATTSRFRELKLQHKEYLCVKAMILLNSSMYPLVTATQDADSSRKLAHLLNAVTDALVWVIAKSGISSQQQSMRLANLLMLLSHVRHASNKGMEHLLNMKCKNVVPVYDLLLEMLNAHVLRGCKSSITGSECSPAEDSKSKEGSQNPQSQ
  
Inhibitor
Name:
BDBM50475361
Synonyms:
CHEMBL363630
Type:
Small organic molecule
Emp. Form.:
C26H22N2O3
Mol. Mass.:
410.4645
SMILES:
CCc1nc2cc(O)ccc2c(Oc2ccc(\C=C\C(N)=O)cc2)c1-c1ccccc1
Structure:
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