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BAY-876 | Inhibitor of SLC2A1
RATINGS:
Cellular Use: (2 reviews)

In Model Organisms: (2 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
SLC2A1
  • IC50:2 nM
  • IC50:3.2 nM
Inhibitor
up to 100 nM

Selectivity

In Vitro Selectivity Assessment
Selectivity Assessment Description:
Selectivity within target family: the closest target is SLC2A4 which is >100x less selective (IC50 = ...

Potency
Cellular
In Vitro

SLC2A1

Mode of Action: Inhibitor

Structure-Activity-Relationship data available? No

DOI Reference: 10.1002/cmdc.201600276

In Vivo Validations

Rat
Dose: 0.3 mg/Kg
Route of delivery: Intravenous
Plasma half life: 2.5 h
Systemic clearance: 0.23 (plasma), 0.33 (blood) L/h/Kg
Volume of Distribution at Steady-State: 0.79 L/Kg

DOI Reference: 10.1002/cmdc.201600276

Dose: 0.6 mg/Kg
Route of delivery: Oral
Cmax: 0.33 Kg/L
Bioavailability: 85%

DOI Reference: 10.1002/cmdc.201600276

Dog
Dose: 0.1 mg/Kg
Route of delivery: Intravenous
Plasma half life: 22 h
Systemic clearance: 0.033 (plasma), 0.059 (blood) L/h/Kg
Volume of Distribution at Steady-State: 1.0 L/Kg

DOI Reference: 10.1002/cmdc.201600276

Dose: 0.2 mg/Kg
Route of delivery: Oral
Cmax: 0.93 Kg/L
Bioavailability: 79%

DOI Reference: 10.1002/cmdc.201600276

Negative Control Compounds

BAY-588
Notes: IC50 SLC2A1 = 1.2 μM; clean GPCR scan

Chemical Information

Molecular Formula C24H16F4N6O2
SMILEs Cc1c(NC(=O)c2cc(C(N)=O)nc3cc(F)ccc23)c(C(F)(F)F)nn1Cc1ccc(C#N)cc1
InChI InChI=1S/C24H16F4N6O2/c1-12-20(21(24(26,27)28)33-34(12)11-14-4-2-13(10-29)3-5-14)32-23(36)17-9-19(22(30)35)31-18-8-15(25)6-7-16(17)18/h2-9H,11H2,1H3,(H2,30,35)(H,32,36)
Molecular weight 496.13 Da
AlogP 4.168800000000002
HBond acceptors 8
HBond donors 3
Atoms 52

Vendors

Note: This is not an exhaustive list and does not indicate endorsement by the portal.

Expert Reviews

by SERP
(on 29 Nov 2021)
Cellular Use Rating
In Model Organisms
(The reviewer did not leave any public comments)
by SERP
(on 3 Dec 2021)
Cellular Use Rating
In Model Organisms
(The reviewer did not leave any public comments)
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