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BAY-091 | BAY-091 : Inhibitor of PIP4K2A
RATINGS:
Cellular Use: (1 reviews)

In Model Organisms: (0 reviews)
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
Vendors
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Probe Summary

Targets Biochemical/Biophysical Potency Cellular Potency
PIP4K2A
  • IC50:1.3 nM
  • IC50:2.6 nM
  • IC50:8.5 nM
  • IC50:16.4 nM
  • IC50:8.5 nM
  • IC50:16.4 nM
Inhibitor
100 nM

Selectivity

In Vitro Selectivity Assessment
Potency Assay Off-Target:
Eurofins-PanLab assays: enzymatic, radioligand binding, kinase panel.
Selectivity Assessment Description:
Closest off-targets [% inhibition] are TBXAS1 (98%), MAOB (81%), PDE3 (74%) and PDE5A (62%) (enzymat ...

Potency
Cellular
In Vitro

PIP4K2A

Mode of Action: Inhibitor

Structure-Activity-Relationship data available? Yes

DOI Reference: 10.1021/acs.jmedchem.1c01245

Negative Control Compounds

BAY-0361
Notes: BAY-0361: Eurofins kinase panel at 1 µM: IC50 = 271 nM (~ 18-fold) No shift was observed in the CETSA assay (intact K-562 cells, 1 h , 37°C) for PIP4K2A and PIP4K2B at 30 µM.

Chemical Information

Molecular Formula C26H21FN4O2
SMILEs CC[C@@H](Nc1c(C#N)c(-c2ccc(-c3cccc(C)c3F)cc2)nc2cnccc12)C(=O)O
InChI InChI=1S/C26H21FN4O2/c1-3-21(26(32)33)30-25-19-11-12-29-14-22(19)31-24(20(25)13-28)17-9-7-16(8-10-17)18-6-4-5-15(2)23(18)27/h4-12,14,21H,3H2,1-2H3,(H,30,31)(H,32,33)/t21-/m1/s1
Molecular weight 440.16 Da
AlogP 0.0
HBond acceptors 6
HBond donors 2
Atoms 54

Vendors

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Expert Reviews

by SERP+
(on 23 May 2024 )
Cellular Use Rating
In Vitro potency was beetwen 1 and 16 nM, orthogonal assay were performed. Potency in cells was 1.1 microM. It was highly selective over 373 kinases. Enantiomer is also available as a negative control....
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