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BAY-805 | BAY-805 : Inhibitor of USP21
RATINGS:
Cellular Use: (2 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
USP21
  • IC50:6 nM
  • % in:95
  • IC50:2 nM
  • % in:85%
  • Kd:2.2 nM
  • EC50:17 nM
Inhibitor
can be used at low concentrations (500 nM)
up to 10 uM

Selectivity

In Vitro Selectivity Assessment
Potency Assay Off-Target:
Within the target family: SGC DUB panel comprising 10 individual USPs tested at 10 and 50 uM showing ...

Potency
Cellular
In Vitro

USP21

Mode of Action: Inhibitor

Structure-Activity-Relationship data available? Yes

DOI Reference: 10.1021/acs.jmedchem.2c01933

Negative Control Compounds

BAY-728
Notes: BAY-728 (cpd 22) had IC50 12600 nM in HTRF assay agaist hUSP21, EC50 >100 uM in CETSA
SMILES: CC(C)C[C@H(NC(=O)C1(CCCCC1)C(F(F)F)C(=O)Nc2nnc(Cc3ccc(cc3)C#N)s2

Chemical Information

Molecular Formula C24H28F3N5O2S
SMILEs CC(C)C[C@@H](NC(=O)C1(C(F)(F)F)CCCCC1)C(=O)Nc1nnc(Cc2ccc(C#N)cc2)s1
InChI InChI=1S/C24H28F3N5O2S/c1-15(2)12-18(29-21(34)23(24(25,26)27)10-4-3-5-11-23)20(33)30-22-32-31-19(35-22)13-16-6-8-17(14-28)9-7-16/h6-9,15,18H,3-5,10-13H2,1-2H3,(H,29,34)(H,30,32,33)/t18-/m1/s1
Molecular weight 507.19 Da
AlogP 0.0
HBond acceptors 7
HBond donors 2
Atoms 63

Expert Reviews

by SERP
(on 23 Jun 2023 )
Cellular Use Rating
( The reviewer did not leave any comments )
by SERP
(on 5 Jul 2023 )
Cellular Use Rating
Excellent probe for the in vitro study of USP21. Use of the negative control suggested in the original is recommended to strengthen any data arising from the use of this probe.
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