| Reaction Details |
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 | Report a problem with these data |
| Target | Estrogen receptor beta |
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| Ligand | BDBM77806 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_834996 (CHEMBL2073449) |
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| EC50 | 4870±n/a nM |
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| Citation |  Shen, J; Jiang, J; Kuang, G; Tan, C; Liu, G; Huang, J; Tang, Y Discovery and structure-activity analysis of selective estrogen receptor modulators via similarity-based virtual screening. Eur J Med Chem54:188-96 (2012) [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 |
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| 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 |
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| Type: | Protein |
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| Mol. Mass.: | 59238.43 |
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| Organism: | Homo sapiens (Human) |
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| Description: | Q92731 |
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| Residue: | 530 |
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| Sequence: | MDIKNSPSSLNSPSSYNCSQSILPLEHGSIYIPSSYVDSHHEYPAMTFYSPAVMNYSIPS
NVTNLEGGPGRQTTSPNVLWPTPGHLSPLVVHRQLSHLYAEPQKSPWCEARSLEHTLPVN
RETLKRKVSGNRCASPVTGPGSKRDAHFCAVCSDYASGYHYGVWSCEGCKAFFKRSIQGH
NDYICPATNQCTIDKNRRKSCQACRLRKCYEVGMVKCGSRRERCGYRLVRRQRSADEQLH
CAGKAKRSGGHAPRVRELLLDALSPEQLVLTLLEAEPPHVLISRPSAPFTEASMMMSLTK
LADKELVHMISWAKKIPGFVELSLFDQVRLLESCWMEVLMMGLMWRSIDHPGKLIFAPDL
VLDRDEGKCVEGILEIFDMLLATTSRFRELKLQHKEYLCVKAMILLNSSMYPLVTATQDA
DSSRKLAHLLNAVTDALVWVIAKSGISSQQQSMRLANLLMLLSHVRHASNKGMEHLLNMK
CKNVVPVYDLLLEMLNAHVLRGCKSSITGSECSPAEDSKSKEGSQNPQSQ
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| BDBM77806 |
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| n/a |
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| Name | BDBM77806 |
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| Synonyms: | 4-[(1,3-dicyclohexyl-2,4,6-triketo-hexahydropyrimidin-5-ylidene)methylamino]benzenesulfonamide | 4-[(1,3-dicyclohexyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methylamino]benzenesulfonamide | 4-[[1,3-dicyclohexyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-ylidene]methylamino]benzenesulfonamide | MLS000910803 | SMR000111907 | cid_5310764 |
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| Type | Small organic molecule |
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| Emp. Form. | C23H30N4O5S |
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| Mol. Mass. | 474.573 |
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| SMILES | [#7]S(=O)(=O)c1ccc(-[#7]\[#6]=[#6]-2\[#6](=O)-[#7](-[#6]-3-[#6]-[#6]-[#6]-[#6]-[#6]-3)-[#6](=O)-[#7](-[#6]-3-[#6]-[#6]-[#6]-[#6]-[#6]-3)-[#6]-2=O)cc1 |
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| Structure | 
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