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BAY1125976 | BAY1125976 : Allosteric inhibitor of AKT2, AKT1
RATINGS:
Cellular Use: (3 reviews)

In Model Organisms: (3 reviews)
Probe Summary
Selectivity
Potency
In Vivo
Control Compounds
Chemical Information
References
Vendors
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Probe Summary

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Targets Biochemical/Biophysical Potency Cellular Potency
AKT2
  • IC 50:18/36 nM Hi/Lo ATP
  • IC 50:0.9 nM (T308); 1.1 nM (S473)
AKT1
  • IC 50: 5.2/44 Hi/Lo ATP
  • Kd:2.7 (active), 1.3 (inactive) nM
  • IC50:0.9 nM (T308); 1.1 nM (S473)
Allosteric
up to 300 nM

Selectivity

In Vitro Selectivity Assessment

Potency: IC50 - AKT3 427 nM @ 10mM ATP

Selectivity Assessment Description:
The selectivity of BAY 1125976 was assessed using two different kinase panels: the 230 kinase Kin ...

Potency
Cellular
In Vitro

AKT2

Mode of Action: Allosteric

Structure-Activity-Relationship data available? Yes

DOI Reference: 10.1002/ijc.30457

AKT1

Mode of Action: Allosteric

Structure-Activity-Relationship data available? Yes

DOI Reference: 10.1002/ijc.30457

In Vivo Validations

Mouse
Dose: 10 - 50 mg/Kg
Route of delivery: Oral

DOI Reference: 10.3390/cancers11121987

Chemical Information

Molecular Formula C23H21N5O
SMILEs NC(=O)c1ccc2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)n2n1
InChI InChI=1S/C23H21N5O/c24-22(29)18-11-12-19-26-20(21(28(19)27-18)16-5-2-1-3-6-16)15-7-9-17(10-8-15)23(25)13-4-14-23/h1-3,5-12H,4,13-14,25H2,(H2,24,29)
Molecular weight 383.17 Da
AlogP 3.5001000000000024
HBond acceptors 6
HBond donors 4
Atoms 50

Vendors

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Expert Reviews

by SERP
(on 4 Nov 2020)
Cellular Use Rating
In Model Organisms
There are several inhibitors of this class, including Miransertib (ARQ092), MK2206, and Borussertib. Miransertib has some advantages with PK (particularly longer half-life: https://pubs.acs.org/doi/full/10.1021/acs.jmedchem.6b00619)...
by SERP
(on 12 Nov 2020)
Cellular Use Rating
In Model Organisms
(The reviewer did not leave any public comments)
by SERP
(on 17 Nov 2020)
Cellular Use Rating
In Model Organisms
(The reviewer did not leave any public comments)
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