Compound name
Tiratricol
Protein family
Nuclear Receptors
Target name
NR1A2
Affinity on-target cellular (nM)
4.13
CG-Set
Nuclear Receptor set
Recommended Concentration
1 µM
Compound EUbOPEN ID
EUB0001139a
SMILES
OC(CC1=CC(I)=C(OC2=CC=C(O)C(I)=C2)C(I)=C1)=O
InChIKey
UOWZUVNAGUAEQC-UHFFFAOYSA-N
Mode of action
Agonist
Affinity on-target cellular definition
EC50
Affinity on-target cellular assay type
Reporter gene assay (HEK293 cells were cotransfected with pGL4.23-PAL-4 or pGL4.23-DR2-4 as reporter, pRL-TK as control and pcDNA3.1-TR? or -TR? as expression plasmid)
Affinity on-target cellular source knowledge
https://doi.org/10.1002/jat.2825
Affinity on-target cellular relation
0
Selectivity platform
Nuclear receptor panel, bromodomain and kinase panel
Selectivity platform number of targets
19
Selectivity remarks
Screened at 1 µM against NR2A1, NR2B1, NR2C1, NR2E1, NR4A1, NR5A1 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): fold-activation = 2.0 (NR5A1); Screened at 20 µM in a bromodomain and kinase panel against ABL1, AURKA, BRD4, BRPF1, CDK2, CSNK1D, FGFR3, GSK3B, MAPK1, TRIM24 in DSF assays: ?Tm(AURKA) = 3.86 K; all other bromodomains or kinases ?Tm < 2 K
Selectivity Number of Off-targets
2