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DDC-03-024-01 | DDC-03-024-01 : Allosteric Inhibitor of EGFR
RATINGS:
Cellular Use: (3 reviews)

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

Targets Biochemical/Biophysical Potency Cellular Potency
EGFR (Mutant:L858R/T790M and L858R/T790M/C797S)
  • IC50:11 nM
  • IC50:13 nM
  • IC50:200 nM
  • IC50:360 nM
Allosteric
up to 1 uM

Selectivity

In Vitro Selectivity Assessment
Selectivity Assessment Description:
Selectivity of inhibitor DDC-03-024-01 against a panel of 468 kinases via KINOMEscan profiling (Disc ...

Potency
Cellular
In Vitro

EGFR (Mutant:L858R/T790M and L858R/T790M/C797S)

Mode of Action: Allosteric

Structure-Activity-Relationship data available? Yes

DOI Reference: 10.1021/acsmedchemlett.9b00381

Chemical Information

Molecular Formula C31H29FN4O2
SMILEs CN1CCN(c2ccc(Oc3ccc4c(c3)C(=O)N(Cc3ccccc3)c3cc(F)ccc3N4)cc2)CC1
InChI InChI=1S/C31H29FN4O2/c1-34-15-17-35(18-16-34)24-8-10-25(11-9-24)38-26-12-14-28-27(20-26)31(37)36(21-22-5-3-2-4-6-22)30-19-23(32)7-13-29(30)33-28/h2-14,19-20,33H,15-18,21H2,1H3
Molecular weight 508.23 Da
AlogP 6.273800000000006
HBond acceptors 6
HBond donors 1
Atoms 67

References

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Cross References

canSARChEMBLBindingDB

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Expert Reviews

by SERP
(on 8 Jul 2022 )
Cellular Use Rating
The allosteric EGFR probe may be useful for elucidating biology and offers an alternative mechanism of inhibition to EFGR orthosteric inhibitors. The cell data suggest a significant disconnect between...
by SERP+
(on 22 Mar 2023 )
Cellular Use Rating
There are not target engagement assays.
by SERP+
(on 23 May 2024 )
Cellular Use Rating
Very selective allosteric kinase inhibitor. The antiproliferative effect is shown in cells. An additional target engagement assay would be nice. Synthetic modifications of the structure of the compound...
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