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XMD-12 | Inhibitor of AURKA, AURKB, AURKC
RATINGS:
Cellular Use: (3 reviews)

In Model Organisms: (2 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
AURKA
  • IC 50:5.6 nM
  • EC 50:16.7 nM
AURKB
  • IC 50:18.4 nM
  • EC 50:16.7 nM
AURKC
  • IC 50:24.6 nM
  • EC 50:16.7 nM
up to 1 uM

Selectivity

In Vitro Selectivity Assessment

Potency: IC50 - LRRK2 30.5 nM , LRRK2 (G2019S) 10.7 nM

Potency Assay Off-Target:
Invitrogen biochemical assay
Selectivity Assessment Description:
Profiled using KINOMEscan @ 1 uM across a panel of 442 kinases: revealed sub-100 nM IC50 against ...

Potency
Cellular
In Vitro

AURKA

Mode of Action: Inhibitor

Structure-Activity-Relationship data available? No

DOI Reference: 10.1021/cb200305u

AURKB

Mode of Action: Inhibitor

Structure-Activity-Relationship data available? No

DOI Reference: 10.1021/cb200305u

AURKC

Mode of Action: Inhibitor

Structure-Activity-Relationship data available? No

DOI Reference: 10.1021/cb200305u

Orthogonal Probes def

MK-5108
AMG-900
AZD1152

Chemical Information

Molecular Formula C24H26N6O2
SMILEs CN1C(=O)c2ccccc2N(C)c2nc(Nc3ccc(N4CCC(O)CC4)cc3)ncc21
InChI InChI=1S/C24H26N6O2/c1-28-20-6-4-3-5-19(20)23(32)29(2)21-15-25-24(27-22(21)28)26-16-7-9-17(10-8-16)30-13-11-18(31)12-14-30/h3-10,15,18,31H,11-14H2,1-2H3,(H,25,26,27)
Molecular weight 430.21 Da
AlogP 3.539200000000002
HBond acceptors 8
HBond donors 2
Atoms 58
PAINS * Yes

* This is an automated alert only, and may not necessarily indicate an issue with this probe. ( Learn more about PAINS )

Vendors

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Expert Reviews

by SERP
(on 18 Oct 2020)
Cellular Use Rating
In Model Organisms
XMD-12 has good kinome-wide selectivity with DCAMKL2, LRRK2, NUAK1 and TAOK1 being the only off targets below 100 nM, but target engagement and cellular inhibition has not been demonstrated for these...
by SERP
(on 2 Dec 2020)
Cellular Use Rating
Compound 1 complements the set of known selective Aurora inhibitors and is among the most kinase selective pan-Aurora inhibitor reported. The established pan-Aurora inhibitor VX680 appears to have...
by SERP
(on 14 Apr 2021)
Cellular Use Rating
In Model Organisms
(The reviewer did not leave any public comments)
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