Reaction Details |
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Target | Estrogen receptor beta |
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Ligand | BDBM50310404 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_622100 (CHEMBL1114099) |
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IC50 | 66±n/a nM |
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Citation | Jain, N; Xu, J; Kanojia, RM; Du, F; Jian-Zhong, G; Pacia, E; Lai, MT; Musto, A; Allan, G; Reuman, M; Li, X; Hahn, D; Cousineau, M; Peng, S; Ritchie, D; Russell, R; Lundeen, S; Sui, Z Identification and structure-activity relationships of chromene-derived selective estrogen receptor modulators for treatment of postmenopausal symptoms. J Med Chem52:7544-69 (2009) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Estrogen receptor beta |
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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: | MDIKNSPSSLNSPSSYNCSQSILPLEHGSIYIPSSYVDSHHEYPAMTFYSPAVMNYSIPS
NVTNLEGGPGRQTTSPNVLWPTPGHLSPLVVHRQLSHLYAEPQKSPWCEARSLEHTLPVN
RETLKRKVSGNRCASPVTGPGSKRDAHFCAVCSDYASGYHYGVWSCEGCKAFFKRSIQGH
NDYICPATNQCTIDKNRRKSCQACRLRKCYEVGMVKCGSRRERCGYRLVRRQRSADEQLH
CAGKAKRSGGHAPRVRELLLDALSPEQLVLTLLEAEPPHVLISRPSAPFTEASMMMSLTK
LADKELVHMISWAKKIPGFVELSLFDQVRLLESCWMEVLMMGLMWRSIDHPGKLIFAPDL
VLDRDEGKCVEGILEIFDMLLATTSRFRELKLQHKEYLCVKAMILLNSSMYPLVTATQDA
DSSRKLAHLLNAVTDALVWVIAKSGISSQQQSMRLANLLMLLSHVRHASNKGMEHLLNMK
CKNVVPVYDLLLEMLNAHVLRGCKSSITGSECSPAEDSKSKEGSQNPQSQ
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BDBM50310404 |
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n/a |
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Name | BDBM50310404 |
Synonyms: | (R)-5-[4-(2-Azepan-1-yl-ethoxy)-phenyl]-8-fluoro-11,12-dihydro-5H-6,13-dioxa-benzo[3,4]cyclohepta[1,2-a]naphthalen-2-ol | CHEMBL1082224 |
Type | Small organic molecule |
Emp. Form. | C31H32FNO4 |
Mol. Mass. | 501.5885 |
SMILES | Oc1ccc2C3=C(CCOc2c1)c1ccc(F)cc1O[C@@H]3c1ccc(OCCN2CCCCCC2)cc1 |r,c:5| |
Structure |
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