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GPR40ant39 | GPR40ant39 : (Predicted) allosteric antagonist of FFAR1
RATINGS:
Cellular Use: (3 reviews)

In Model Organisms: (3 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
FFAR1
  • IC50:160 nM
  • IC50:160 nM
Antagonist
16 nM - 1.6 uM

Selectivity

In Vitro Selectivity Assessment

Potency: IC50 - Na+/K+ ATPase (pig): 790 nM

Potency Assay Off-Target:
The compound had no activity in CEREP panel, including 144 GPCRs, at 1 uM. The above is the only tar ...
Selectivity Assessment Description:
hERG pIC50=5.0

Potency
Cellular
In Vitro

FFAR1

Mode of Action: Antagonist

Structure-Activity-Relationship data available? No

In Vivo Validations

male Zucker fa/fa rat
Dose: 80 mg/kg
Route of delivery: Oral
Plasma half life: 69 min
Systemic clearance: 30 mL/min/kg
Target engagement assay: Indirect. In beta-3 agonist challenge assays (lipolysis), GPR40ant39 inhibited nonesterified fatty acid (NEFA)-driven insulin resistance.

Reference: --

Orthogonal Probes def

FASIGLIFAM
TUG-469
AMG-837

Chemical Information

Molecular Formula C21H16F3N5O
SMILEs CC1(C#N)CN(c2cc(COc3ccc(F)c(F)c3F)nc(-c3ccccn3)n2)C1
InChI InChI=1S/C21H16F3N5O/c1-21(10-25)11-29(12-21)17-8-13(27-20(28-17)15-4-2-3-7-26-15)9-30-16-6-5-14(22)18(23)19(16)24/h2-8H,9,11-12H2,1H3
Molecular weight 411.13 Da
AlogP 3.8847800000000037
HBond acceptors 6
HBond donors --
Atoms 46

References

Publications

Cross References

canSARChEMBL

Vendors

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Expert Reviews

by SERP
(on 6 Jun 2017)
Cellular Use Rating
In Model Organisms
A TR-FRET assay was employed, which indirectly demonstrated target antagonism (IC50=160 nM). Off-target activity was demonstrated on a panel of 144 GPCRs, including two family members, GPR43 (FFAR2)...
by SERP
(on 14 Jul 2017)
Cellular Use Rating
In Model Organisms
Essentially this probe has been demonstrated to have selectivity for FFAR1 in in vitro studies with transfected cells. There is limited off-target profiling at GPCRs and, at high concentrations, some...
by SERP
(on 9 Aug 2017)
Cellular Use Rating
In Model Organisms
GPR40ant39 is the result of a high-throughput screen in HEK cells transfected with GPR40 and stimulated with elaidic acid. Levels of the secondary messenger IP1 were measured as an endpoint. A medicinal...
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