Compound name
Diethylstilbestrol
Protein family
Nuclear Receptors
Target name
NR3A2
Affinity on-target cellular (nM)
0.02
CG-Set
Nuclear Receptor set
Recommended Concentration
0.3 µM
Compound EUbOPEN ID
EUB0002144a
SMILES
CCC(=C(CC)C1=CC=C(C=C1)O)C2=CC=C(C=C2)O
InChIKey
RGLYKWWBQGJZGM-UHFFFAOYSA-N
Mode of action
Agonist
Affinity on-target cellular definition
EC50
Affinity on-target cellular assay type
Reporter gene assay (HeLa cells)
Affinity on-target cellular source knowledge
https://doi.org/10.1021/jm015577l
Affinity on-target cellular relation
0
Selectivity platform
Nuclear receptor panel, bromodomain and kinase panel, literature
Selectivity platform number of targets
23
Selectivity remarks
Screened at 0.3 µM against NR1A1, NR1B1, NR1C3, NR1F3, NR1H3, NR1I1, NR1I2, NR1I3, NR2A1, NR2B1, NR4A1, NR5A2 and VP16 in a Gal4 hybrid reporter gene assay (HEK293T cells were cotransfected with pFR-Luc reporter, pRL-SV40 control reporter and pFA-CMV containing the Gal4-DBD fused with human NR-LBD of interest or pECE-SV40-Gal4-VP16): clean selectivty profile with no significant agonism/antagonism detected; Screened at 20 µM in a bromodomain and kinase panel against ABL1, AURKA, BRD4, BRPF1, CDK2, CSNK1D, FGFR3, GSK3B, MAPK1, TRIM24 in DSF assays: clean selectivity profile with no significant binding (?Tm < 2 K); IC50 = 460 - 500 nM (AOX) reported in literature
Selectivity Source Knowledge
https://doi.org/10.1021/jm100888d
Selectivity Number of Off-targets
1