Reaction Details Report a problem with these data
Target
Estrogen receptor beta
Ligand
BDBM50431198
Substrate
n/a
Meas. Tech.
ChEMBL_948804 (CHEMBL2339766)
EC50
1870±n/a nM
Citation
 Min, J; Wang, P; Srinivasan, S; Nwachukwu, JC; Guo, P; Huang, M; Carlson, KE; Katzenellenbogen, JA; Nettles, KW; Zhou, HB Thiophene-core estrogen receptor ligands having superagonist activity. J Med Chem 56:3346-66 (2013) [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:
BDBM50431198
Synonyms:
CHEMBL2031541
Type:
Small organic molecule
Emp. Form.:
C18H16O2S
Mol. Mass.:
296.383
SMILES:
Cc1cc(O)ccc1-c1cscc1-c1ccc(O)cc1C
Structure:
Search PDB for entries with ligand similarity: