Reaction Details Report a problem with these data
Target
Estrogen receptor beta
Ligand
BDBM50252822
Substrate
n/a
Meas. Tech.
ChEBML_1685131
EC50
894±n/a nM
Citation
 Yang, L; Hu, Z; Luo, J; Tang, C; Zhang, S; Ning, W; Dong, C; Huang, J; Liu, X; Zhou, HB Dual functional small molecule fluorescent probes for image-guided estrogen receptor-specific targeting coupled potent antiproliferative potency for breast cancer therapy. Bioorg Med Chem 25:3531-3539 (2017) [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:
BDBM50252822
Synonyms:
CHEMBL4076313
Type:
Small organic molecule
Emp. Form.:
C16H11ClO4
Mol. Mass.:
302.709
SMILES:
Cc1c(-c2ccc(O)cc2Cl)c(=O)oc2cc(O)ccc12 |(9.69,-39.37,;9.7,-40.91,;11.04,-41.68,;12.37,-40.91,;13.7,-41.68,;15.03,-40.91,;15.03,-39.37,;16.36,-38.59,;13.69,-38.6,;12.36,-39.38,;11.02,-38.62,;11.05,-43.23,;12.38,-43.99,;9.71,-44,;8.38,-43.24,;7.04,-44.01,;5.71,-43.24,;4.37,-44.01,;5.71,-41.7,;7.04,-40.93,;8.37,-41.69,)|
Structure:
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