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DDR1-IN-1 | DDR1-IN-1 : Inhibitor of DDR1
RATINGS:
Cellular Use: (3 reviews)

In Model Organisms: (1 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
DDR1
  • IC50:105 nM
  • EC50:86 nM
Inhibitor
50 nM - 200 nM

Selectivity

In Vitro Selectivity Assessment

Potency: IC50 - DDR2 413 nM

Potency Assay Off-Target:
KinomeScan binding assay revealed off-target activity against ABL, KIT and PDGFRbeta

Potency
Cellular
In Vitro

DDR1

Mode of Action: Inhibitor

Structure-Activity-Relationship data available? No

Orthogonal Probes def

BAY-826

Chemical Information

Molecular Formula C30H31F3N4O3
SMILEs CCN1CCN(Cc2ccc(C(=O)Nc3ccc(C)c(Oc4ccc5c(c4)CC(=O)N5)c3)cc2C(F)(F)F)CC1
InChI InChI=1S/C30H31F3N4O3/c1-3-36-10-12-37(13-11-36)18-21-6-5-20(15-25(21)30(31,32)33)29(39)34-23-7-4-19(2)27(17-23)40-24-8-9-26-22(14-24)16-28(38)35-26/h4-9,14-15,17H,3,10-13,16,18H2,1-2H3,(H,34,39)(H,35,38)
Molecular weight 552.23 Da
AlogP 4.0672
HBond acceptors 7
HBond donors 2
Atoms 71

References

Publications

    Cross References

    canSARChEMBLBindingDBPDBe (Protein Data Bank Europe)

    Vendors

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    Expert Reviews

    by SERP
    (on 19 Jun 2016 )
    Cellular Use Rating
    DDR1-IN-1 has modest biochemical selectivity (4X) for DDR1 over DDR2, but shows excellent broader selectivity across the KinomeScan panel when tested at 1 uM (S(1) at 1 uM of 0.01). DDR1-IN-1 demonstrates...
    by SERP
    (on 20 Jun 2016 )
    Cellular Use Rating
    DDR1-IN-1 is selective across 451 kinases with selectivity score (S(1) at 1 uM) of 0.01, as assessed with the KinomeScan approach. It is more effective in combination with inhibitors against EGFR, SRC,...
    by SERP
    (on 19 Nov 2020 )
    Cellular Use Rating
    In Model Organisms
    ( The reviewer did not leave any comments )
    Note: The Chemical Probes Portal only endorses compounds as chemical probes for use as specific and selective modulators of the proposed target if they receive three or more (3-4) stars. Read more about our evaluation criteria