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BYL-719 | BYL-719 : ATP competitive inhibitor of PIK3CA
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

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Targets Biochemical/Biophysical Potency Cellular Potency
PIK3CA
  • IC50:5 nM
  • IC50:74 nM
ATP competitive
10 nM - 1 uM

Selectivity

In Vitro Selectivity Assessment

Potency: IC50 - PIK3CB 1200 nM, PIK3CD 290 nM, PIK3CG 250 nM

Potency Assay Off-Target:
In vitro kinase assay. BYL-719 was >50-fold selective of PIK3CA over 442 kinases in vitro (Ambit). ...
Selectivity Assessment Description:
IC50 for CYP450A > 10 uM
In Cell Selectivity Assessment

Potency: IC50 - PI3KCB 2200 nM, PI3KCD 1200 nM

Potency
Cellular
In Vitro

PIK3CA

Mode of Action: ATP competitive

Structure-Activity-Relationship data available? Yes

PMID Reference: 23726034

In Vivo Validations

Rat
Dose: 1 mg/kg
Route of delivery: Intravenous
Plasma half life: 2. 9 hr
Systemic clearance: 10 mL/min/kg

PMID Reference: 23726034

Orthogonal Probes def

Pictilisib

Chemical Information

Molecular Formula C19H22F3N5O2S
SMILEs Cc1nc(NC(=O)N2CCC[C@H]2C(N)=O)sc1-c1ccnc(C(C)(C)C(F)(F)F)c1
InChI InChI=1S/C19H22F3N5O2S/c1-10-14(11-6-7-24-13(9-11)18(2,3)19(20,21)22)30-16(25-10)26-17(29)27-8-4-5-12(27)15(23)28/h6-7,9,12H,4-5,8H2,1-3H3,(H2,23,28)(H,25,26,29)/t12-/m0/s1
Molecular weight 441.14 Da
AlogP 3.835020000000002
HBond acceptors 7
HBond donors 3
Atoms 52

References

Publications

Cross References

canSARChEMBLBindingDBPDB

Vendors

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Expert Reviews

by SERP
(on 10 Jun 2016)
Cellular Use Rating
In Model Organisms
(The reviewer did not leave any public comments)
by SERP
(on 18 Jun 2016)
Cellular Use Rating
In Model Organisms
Chemical Neighbourhood for QSAR: 15 molecules similar (>0.80) to BYL-719 with in vitro affinities for PIK3CA were found in public repositories (e.g., ChEMBL).
by SERP
(on 5 Jul 2017)
Cellular Use Rating
In Model Organisms
(The reviewer did not leave any public comments)
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