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XMD8-87 | XMD8-87 : ATP competitive Inhibitor of TNK2
RATINGS:
Cellular Use: (3 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
TNK2
  • KD, IC50:15, 35.4 nM
  • IC50:38 nM (D163E); ; 113 nM (R806Q)
ATP competitive
up to 500 nM

Selectivity

In Vitro Selectivity Assessment

Potency: KD, IC50 - BRK 37 nM, 47 nM

Potency Assay Off-Target:
Ambit binding assay, Invitrogen kinase assay
Selectivity Assessment Description:
CSF1R (330 nM Kd in Ambit binding assay, 428 nM IC50 in Invitrogen kinase assay); DCAMKL1 (280 nM ...

Potency
Cellular
In Vitro

TNK2

Mode of Action: ATP competitive

Structure-Activity-Relationship data available? No

Chemical Information

Molecular Formula C24H27N7O2
SMILEs COc1cc(N2CCN(C)CC2)ccc1Nc1ncc2c(n1)N(C)c1ccccc1C(=O)N2
InChI InChI=1S/C24H27N7O2/c1-29-10-12-31(13-11-29)16-8-9-18(21(14-16)33-3)27-24-25-15-19-22(28-24)30(2)20-7-5-4-6-17(20)23(32)26-19/h4-9,14-15H,10-13H2,1-3H3,(H,26,32)(H,25,27,28)
Molecular weight 445.22 Da
AlogP 0.0
HBond acceptors 9
HBond donors 2
Atoms 60

Vendors

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Expert Reviews

by SERP
(on 9 Nov 2020 )
Cellular Use Rating
...
by SERP
(on 18 Feb 2021 )
Cellular Use Rating
This probe is based on a well-known scaffold that has yielded inhibitors of various kinases, including the ones listed in the specificity section, and ERK5. The scaffold also has a known bromodomain...
by SERP
(on 19 Apr 2021 )
Cellular Use Rating
The selectivity of XMD-8-87 is concerning with respect to BRK and FRK. If XMD-8-87 is to be used as a probe for ACK1, care must be exercised to exclude off-targets BRK and FRK. There is no data on non...
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