====== Beta-Estradiol 0.55μM R07 exp425 ====== ==== Mechanism of Action ==== Agonist for estrogen receptor (ER), inactive control for 2-Methoxyestradiol * **Class / Subclass 1:** Gene Regulation / Transcription Activator * **Class / Subclass 2:** Metabolism / Hormone Agonist ==== Technical Notes ==== * **PubChem Name:** %%Estradiol%% * **Synonyms:** β-Estradiol; E2; 17β-Estradiol; 17β-Oestradiol * **CAS #:** 50-28-2 * **PubChem CID:** [[https://pubchem.ncbi.nlm.nih.gov/compound/5757|5757]] * **IUPAC:** %%(8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol%% * **INCHI Name:** InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1 * **INCHI Key:** VOXZDWNPVJITMN-ZBRFXRBCSA-N * **Molecular Weight:** 272.4 * **Canonical SMILES:** CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)O * **Isomeric SMILES:** C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C=CC(=C4)O * **Molecular Formula:** C18H24O2 {{:chemogenomics:structures:chem-0255.svg?nolink}} * **Supplier Name:** Sigma-Aldrich * **Catalog #:** E-2758 * **Lot #:** 025K1075 * **LCMS:** Tr 1.23 min, m/z 255+ [M+H-H2O]+ * **Platform ID:** 12-beta-estradiol * **Min:** -11.4539; **Max:** 9.0892 {{:chemogenomics:dose_response:dr_487.png?nolink&500 |}} \\ \\ \\ \\ |< 300px 100px 200px >| ^ IC ^ Concentration (µM) ^ | IC10 |N/A | | IC20 |N/A | | IC30 |N/A | | IC40 |N/A | | IC50 |N/A | | IC60 |N/A | | IC70 |N/A | | IC80 |N/A | | IC90 |N/A | \\ ==== Screen Summary ==== * **Round**: 07 * **Dose**: 550nM * **Days of incubation**: 8 * **Doublings**: 7.0 * **Numbers of reads**: 25360615 ==== Screen Results ==== ^Sensitive/Resistant hits (FDR<0.05)^CRANKS^Score Plot^Top 30 Genes^Screen Similarity^Top 30 Sensitive GO terms^Top 30 Resistant GO terms^ |0/0|[[https://files.tyerslab.com/files/public/chemogenomics/cranks/Beta-Estradiol_0.55uM_Round-7_exp425.txt|Scores]]|||||| {{:chemogenomics:cranks_plots:exp425.png?nolink}} ^Gene^CRANKS Score^FDR^ |[[:human_genes:G:GTF3C6|GTF3C6]]|-2.51|0.45| |[[:human_genes:A:ASB3|ASB3]]|-2.50|0.45| |[[:human_genes:W:WRB|WRB]]|-2.28|0.72| |[[:human_genes:S:SEPHS1|SEPHS1]]|-2.12|0.72| |[[:human_genes:C:CDIPT|CDIPT]]|-2.07|0.83| |[[:human_genes:L:LOC643802|LOC643802]]|-2.07|0.72| |[[:human_genes:T:TRMT10A|TRMT10A]]|-2.06|0.72| |[[:human_genes:M:MMP1|MMP1]]|-2.02|0.72| |[[:human_genes:E:ELF2|ELF2]]|-2.00|0.72| |[[:human_genes:R:RIN2|RIN2]]|-2.00|0.72| |[[:human_genes:M:MST1L|MST1L]]|-1.99|0.72| |[[:human_genes:N:NTSR2|NTSR2]]|-1.99|0.72| |[[:human_genes:T:TMED10|TMED10]]|-1.97|0.72| |[[:human_genes:K:KRTAP10-4|KRTAP10-4]]|-1.97|0.83| |[[:human_genes:L:LRRC23|LRRC23]]|-1.95|0.81| |[[:human_genes:T:TP53BP1|TP53BP1]]|-1.94|0.72| |[[:human_genes:P:PARL|PARL]]|-1.92|0.72| |[[:human_genes:F:FBXO11|FBXO11]]|-1.91|0.72| |[[:human_genes:C:CALM2|CALM2]]|-1.90|0.76| |[[:human_genes:B:BBS9|BBS9]]|-1.89|0.72| |[[:human_genes:E:EXOC3|EXOC3]]|-1.89|0.72| |[[:human_genes:K:KRTAP16-1|KRTAP16-1]]|-1.89|0.72| |[[:human_genes:I:ILKAP|ILKAP]]|-1.88|0.81| |[[:human_genes:S:SPC24|SPC24]]|-1.88|0.88| |[[:human_genes:C:CYP4X1|CYP4X1]]|-1.87|0.72| |[[:human_genes:T:TXNDC11|TXNDC11]]|-1.85|0.81| |[[:human_genes:N:NKX6-3|NKX6-3]]|-1.85|0.72| |[[:human_genes:R:RGN|RGN]]|-1.84|0.72| |[[:human_genes:T:THG1L|THG1L]]|-1.84|0.72| |[[:human_genes:T:TAF5L|TAF5L]]|-1.84|0.81| |[[:human_genes:G:GATSL1|GATSL1]]|1.95|0.53| |[[:human_genes:S:SF3B1|SF3B1]]|1.96|0.52| |[[:human_genes:F:FGGY|FGGY]]|1.97|0.52| |[[:human_genes:D:DIEXF|DIEXF]]|1.97|0.61| |[[:human_genes:A:ARID5A|ARID5A]]|1.97|0.52| |[[:human_genes:C:CCDC41|CCDC41]]|1.98|0.53| |[[:human_genes:R:RGS19|RGS19]]|2.01|0.49| |[[:human_genes:C:CDC25C|CDC25C]]|2.01|0.49| |[[:human_genes:A:ACCSL|ACCSL]]|2.01|0.52| |[[:human_genes:A:AASDH|AASDH]]|2.02|0.49| |[[:human_genes:C:CCKAR|CCKAR]]|2.04|0.49| |[[:human_genes:S:SEC13|SEC13]]|2.05|0.68| |[[:human_genes:C:CIC|CIC]]|2.06|0.49| |[[:human_genes:S:SLC22A6|SLC22A6]]|2.07|0.49| |[[:human_genes:R:RPS16|RPS16]]|2.07|0.53| |[[:human_genes:U:UTP20|UTP20]]|2.11|0.53| |[[:human_genes:P:PCDHB12|PCDHB12]]|2.12|0.49| |[[:human_genes:E:EIF4EBP3|EIF4EBP3]]|2.12|0.49| |[[:human_genes:P:POLR2F|POLR2F]]|2.13|0.58| |[[:human_genes:K:KDM6A|KDM6A]]|2.13|0.49| |[[:human_genes:K:KIAA2022|KIAA2022]]|2.14|0.49| |[[:human_genes:C:CPB2|CPB2]]|2.19|0.49| |[[:human_genes:T:TAB3|TAB3]]|2.24|0.49| |[[:human_genes:P:POLE|POLE]]|2.32|0.52| |[[:human_genes:P:PLK4|PLK4]]|2.39|0.53| |[[:human_genes:T:TRIM52|TRIM52]]|2.40|0.53| |[[:human_genes:U:USP17L17|USP17L17]]|2.42|0.80| |[[:human_genes:D:DHX38|DHX38]]|2.45|0.49| |[[:human_genes:Z:ZNF41|ZNF41]]|2.52|0.34| |[[:human_genes:M:MGAT4D|MGAT4D]]|2.60|0.73| No correlation data above threshold. (correlation > 0.05) No GO term hits below threshold. (FDR <0.05) No GO term hits below threshold. (FDR <0.05)