Compound name
SAFit2
Target name
FKBP5
Affinity biochemical (nM)
6
Affinity on-target cellular (nM)
493
CG-Set
Other targets set
Recommended Concentration
1 µM
Compound EUbOPEN ID
EUB0001552a
SMILES
COc1ccc(CC[C@@H](OC(=O)[C@@H]2CCCCN2C(=O)[C@H](c2cc(OC)c(OC)c(OC)c2)C2CCCCC2)c2cccc(OCCN3CCOCC3)c2)cc1OC
InChIKey
ZDBWLRLGUBSLPG-FDHYQTMZSA-N
NCBI gene ID
2289
UniProt ID
Q13451
Synonyms
AIG6, FKBP51, FKBP54, P54, PPIase, Ptg-10
Mode of action
Inhibitor
Negative control
ddSAFit2
Affinity biochemical definition
Kd
Affinity biochemical assay type
Competitive fluorescence polarization binding assay
Affinity Biochemical Source Knowledge
https://www.sgc-ffm.uni-frankfurt.de/chemProbes#!specificprobeoverview/SAFit2
Affinity biochemical relation
0
Affinity on-target cellular definition
IC50
Affinity on-target cellular assay type
NanoBRET assay (HEK293T cells)
Affinity on-target cellular source knowledge
https://chemistry-europe.onlinelibrary.wiley.com/doi/10.1002/cbic.202100113
Affinity on-target cellular relation
0
Selectivity platform
GPCR panel (PDSD screen)
Selectivity platform number of targets
45
Selectivity remarks
Screened at 10 µM, in-vitro potencies of closest targets: Ki(TMEM97) = 226 nM, Ki(HRH4) = 3382 nM, Ki(HTR2C) >10000 nM, Ki(DRD2) >10000 nM; Selectivity within target family (competition fluorescence polarization binding assay): Kd(FKBP1A) = 116.4 nM, Kd(FKBP1B) = 38.9 nM, Kd(FKBP2) = 1053 nM, Kd(FKBP3) >10 µM, Kd(FKBP4) >50 µM; In-cellular follow up of closest targets within family (NanoBRET assay in HEK293T cells, FKBP51-NLuc): IC50(FKBP1A) = 771 nM, IC50(FKBP1B) = 80 nM, IC05(FKBP4) = 1409 nM
Selectivity Source Knowledge
https://www.sgc-ffm.uni-frankfurt.de/chemProbes#!specificprobeoverview/SAFit2
Selectivity Number of Off-targets
0