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MRK952 | MRK952 : Inhibitor of NUDT5
RATINGS:
Cellular Use: (1 reviews)

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

Targets Biochemical/Biophysical Potency Cellular Potency
NUDT5
  • IC50:85 nM
  • Kd:31 ± 18 nM
  • EC50:23.5 ± 4 nM
Inhibitor
up to 1 uM

Selectivity

In Vitro Selectivity Assessment
Potency Assay Off-Target:
Selectivity against the NUDT family was investigated via SPR with no hits.

Potency
Cellular
In Vitro

NUDT5

Mode of Action: Inhibitor

Structure-Activity-Relationship data available? No

Other Reference: Peer reviewed at SGC

Orthogonal Probes def

TH5427

Chemical Information

Molecular Formula C20H20ClF3N6
SMILEs Cn1cnc2ncnc(N3CC[C@@]4(CCN(c5ccc(C(F)(F)F)c(Cl)c5)C4)C3)c21
InChI InChI=1S/C20H20ClF3N6/c1-28-12-27-17-16(28)18(26-11-25-17)30-7-5-19(10-30)4-6-29(9-19)13-2-3-14(15(21)8-13)20(22,23)24/h2-3,8,11-12H,4-7,9-10H2,1H3/t19-/m1/s1
Molecular weight 436.14 Da
AlogP 0.0
HBond acceptors 6
HBond donors --
Atoms 50

Expert Reviews

by SERP
(on 24 Jul 2023 )
Cellular Use Rating
MRK-952 is a chemical probe for NUDT5. It binds the protein with an 31 nM IC50, whereas no binding was detected to a panel of 11 other NUDT family members. In a cellular assay, the compound inhibited NUDT5...
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