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MLi-2 | Inhibitor of LRRK2
RATINGS:
Cellular Use: (2 reviews)

In Model Organisms: (2 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
LRRK2
  • IC50:1.8 nM
  • IC50:3.5 nM
Inhibitor
up to 1 uM

Selectivity

In Vitro Selectivity Assessment

Potency: IC50

Potency Assay Off-Target:
KinomeScan
Selectivity Assessment Description:
> 100-fold kinome selective with IC50 < 1 µM for the following kinases: CLK4 (225 nM), MAP3 ...
In Cell Selectivity Assessment
Potency Assay Off-Target:
PanLabs Profiling
Selectivity Assessment Description:
PanLabs Profile shows 5 hits > 50% inhibition (@ 10 μM): HTR2B (1.2 µM), SLC6A2 (3.8 µM), CHRM ...

Potency
Cellular
In Vitro

LRRK2

Mode of Action: Inhibitor

Structure-Activity-Relationship data available? No

In Vivo Validations

Mouse, Rat
Dose: 30 mg/Kg Oral, 2 mg/Kg IV
Route of delivery: Intravenous, Oral
Organ of interest (O): Brain

Reference: --

Negative Control Compounds

MLi-2-NC

Orthogonal Probes def

GNE7915

Chemical Information

Molecular Formula C21H25N5O2
SMILEs C[C@H]1CN(c2cc(-c3n[nH]c4ccc(OC5(C)CC5)cc34)ncn2)C[C@@H](C)O1
InChI InChI=1S/C21H25N5O2/c1-13-10-26(11-14(2)27-13)19-9-18(22-12-23-19)20-16-8-15(28-21(3)6-7-21)4-5-17(16)24-25-20/h4-5,8-9,12-14H,6-7,10-11H2,1-3H3,(H,24,25)/t13-,14+
Molecular weight 379.20 Da
AlogP 3.5648000000000026
HBond acceptors 7
HBond donors 1
Atoms 53

References

Publications

    Cross References

    SGC additional analysis

    Vendors

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    Expert Reviews

    by SERP
    (on 5 Jun 2020 )
    Cellular Use Rating
    In Model Organisms
    In a mouse model of idiopathic PD, MLi-2 was well-tolerated and showed robust target engagement. However, LRRK2 kinase inhibition in the MitoPark model did not prevent motor dysfunction, α-synuclein...
    by SERP
    (on 3 Jul 2020 )
    Cellular Use Rating
    In Model Organisms
    While there are multiple commercially available LRRK inhibitors available, MLi-2 provides another quality chemical probe to help validate this target in cell-based assays.
    Note: The Chemical Probes Portal only endorses compounds as chemical probes for use as specific and selective modulators of the proposed target if they receive three or more (3-4) stars. Read more about our evaluation criteria