alpelisib [Ligand Id: 7955] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL2396661 (Piqray, Alpelisib, NVP-BYL719, BYL-719)
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  • protein kinase, DNA-activated, catalytic subunit/DNA-dependent protein kinase in Human [ChEMBL: CHEMBL3142] [GtoPdb: 2800] [UniProtKB: P78527]
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  • phosphatidylinositol 3-kinase catalytic subunit type 3/Phosphatidylinositol 3-kinase catalytic subunit type 3 in Human [ChEMBL: CHEMBL1075165] [GtoPdb: 2152] [UniProtKB: Q8NEB9]
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  • phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit beta in Human [GtoPdb: 2154] [UniProtKB: P42338]
  • phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit beta/Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform in Rat [ChEMBL: CHEMBL3608198] [GtoPdb: 2154] [UniProtKB: Q9Z1L0]
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  • phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit alpha/PI3-kinase p110-alpha subunit in Human [ChEMBL: CHEMBL4005] [GtoPdb: 2153] [UniProtKB: P42336]
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  • phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit beta/PI3-kinase p110-beta subunit in Human [ChEMBL: CHEMBL3145] [GtoPdb: 2154] [UniProtKB: P42338]
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  • phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit delta/PI3-kinase p110-delta subunit in Human [ChEMBL: CHEMBL3130] [GtoPdb: 2155] [UniProtKB: O00329]
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  • phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit gamma/PI3-kinase p110-gamma subunit in Human [ChEMBL: CHEMBL3267] [GtoPdb: 2156] [UniProtKB: P48736]
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  • ATM serine/threonine kinase/Serine-protein kinase ATM in Human [ChEMBL: CHEMBL3797] [GtoPdb: 1934] [UniProtKB: Q13315]
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  • ATR serine/threonine kinase/Serine-protein kinase ATR in Human [ChEMBL: CHEMBL5024] [GtoPdb: 1935] [UniProtKB: Q13535]
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  • mechanistic target of rapamycin kinase/Serine/threonine-protein kinase mTOR in Human [ChEMBL: CHEMBL2842] [GtoPdb: 2109] [UniProtKB: P42345]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
Cellular tumor antigen p53 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4096] [UniProtKB: P04637]
ChEMBL Inhibition of p53 (unknown origin) phosphorylation at Ser15 by cell-based assay B 5 pIC50 >10000 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
protein kinase, DNA-activated, catalytic subunit/DNA-dependent protein kinase in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3142] [GtoPdb: 2800] [UniProtKB: P78527]
ChEMBL Inhibition of DNA-PK (unknown origin) B 5.04 pIC50 >9100 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
phosphatidylinositol 3-kinase catalytic subunit type 3/Phosphatidylinositol 3-kinase catalytic subunit type 3 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1075165] [GtoPdb: 2152] [UniProtKB: Q8NEB9]
ChEMBL Inhibition of VPS34 (unknown origin) B 5.04 pIC50 >9100 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit beta in Human [GtoPdb: 2154] [UniProtKB: P42338]
GtoPdb - - 5.92 pIC50 1200 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-8 [PMID:23726034]
phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit beta/Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3608198] [GtoPdb: 2154] [UniProtKB: Q9Z1L0]
ChEMBL Inhibition of PI3Kbeta in rat Rat1 cells assessed as reduction of Akt phosphorylation at Ser473 in presence of 0.5% fetal calf serum B 5.66 pIC50 2200 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3569-3574 [PMID:26206504]
phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit alpha/PI3-kinase p110-alpha subunit in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4005] [GtoPdb: 2153] [UniProtKB: P42336]
ChEMBL Inhibition of N-terminal myristoylated P110alpha (unknown origin)-mediated AKT phosphorylation at Ser473 expressed in rat Rat1 cells by ELISA B 7.13 pIC50 74 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
ChEMBL Inhibition of myristoylated human P110alpha expressed in Rat1 cells assessed as inhibition of Akt phosphorylation at Serine 473 by Western blot analysis B 7.13 pIC50 74 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3582-3584 [PMID:26164189]
GtoPdb - - 8.3 pIC50 5 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-8 [PMID:23726034]
ChEMBL Inhibition of PI3Kalpha (unknown origin) B 8.3 pIC50 5 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3569-3574 [PMID:26206504]
ChEMBL Inhibition of P110alpha (unknown origin) by Kinase-Glo assay B 8.3 pIC50 5 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3582-3584 [PMID:26164189]
ChEMBL Inhibition of P110alpha (unknown origin) using L-a-phosphatidylinositol as substrate by luminescence assay B 8.3 pIC50 5 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
ChEMBL Inhibition of P13Kalpha (unknown origin) B 8.3 pIC50 5 nM IC50 Bioorg Med Chem (2017) 25: 2657-2665 [PMID:28341403]
ChEMBL Inhibition of recombinant PI3Kalpha (unknown origin) by KinaseGlo assay B 8.34 pIC50 4.6 nM IC50 J Med Chem (2017) 60: 47-65 [PMID:27644332]
phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit beta/PI3-kinase p110-beta subunit in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3145] [GtoPdb: 2154] [UniProtKB: P42338]
ChEMBL Inhibition of N-terminal myristoylated P110beta (unknown origin)-mediated AKT phosphorylation at Ser473 expressed in rat Rat1 cells by ELISA B 5.66 pIC50 2200 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
ChEMBL Inhibition of myristoylated human P110beta expressed in Rat1 cells assessed as inhibition of Akt phosphorylation at Serine 473 by Western blot analysis B 5.66 pIC50 2200 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3582-3584 [PMID:26164189]
GtoPdb - - 5.92 pIC50 1200 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-8 [PMID:23726034]
ChEMBL Inhibition of P110beta (unknown origin) using L-a-phosphatidylinositol as substrate by luminescence assay B 5.92 pIC50 1200 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
ChEMBL Inhibition of P110beta (unknown origin) by Kinase-Glo assay B 5.92 pIC50 1200 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3582-3584 [PMID:26164189]
ChEMBL Inhibition of PI3Kbeta (unknown origin) B 5.92 pIC50 1200 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3569-3574 [PMID:26206504]
phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit delta/PI3-kinase p110-delta subunit in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3130] [GtoPdb: 2155] [UniProtKB: O00329]
ChEMBL Inhibition of N-terminal myristoylated P110delta (unknown origin)-mediated AKT phosphorylation at Ser473 expressed in rat Rat1 cells by ELISA B 5.92 pIC50 1200 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
ChEMBL Inhibition of myristoylated human P110delta expressed in Rat1 cells assessed as inhibition of Akt phosphorylation at Serine 473 by Western blot analysis B 5.92 pIC50 1200 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3582-3584 [PMID:26164189]
ChEMBL Inhibition of P110delta (unknown origin) using PIP2:PS as substrate by TR-FRET assay B 6.54 pIC50 290 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
ChEMBL Inhibition of P110delta (unknown origin) using PI or PIP2:PS as substrate measured for 15 to 60 mins by TR-FRET analysis B 6.54 pIC50 290 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3582-3584 [PMID:26164189]
ChEMBL Inhibition of PI3Kdelta (unknown origin) B 6.54 pIC50 290 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3569-3574 [PMID:26206504]
GtoPdb - - 6.54 pIC50 290 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-8 [PMID:23726034]
phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit gamma/PI3-kinase p110-gamma subunit in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3267] [GtoPdb: 2156] [UniProtKB: P48736]
GtoPdb - - 6.6 pIC50 250 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-8 [PMID:23726034]
ChEMBL Inhibition of P110gamma (unknown origin) using PIP2:PS as substrate by TR-FRET assay B 6.6 pIC50 250 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
ChEMBL Inhibition of P110gamma (unknown origin) using PI or PIP2:PS as substrate measured for 15 to 60 mins by TR-FRET analysis B 6.6 pIC50 250 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3582-3584 [PMID:26164189]
ChEMBL Inhibition of PI3Kgamma (unknown origin) B 6.6 pIC50 250 nM IC50 Bioorg. Med. Chem. Lett. (2015) 25: 3569-3574 [PMID:26206504]
ATM serine/threonine kinase/Serine-protein kinase ATM in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3797] [GtoPdb: 1934] [UniProtKB: Q13315]
ChEMBL Inhibition of ATM (unknown origin) phosphorylation at Ser1981 by cell-based assay B 5 pIC50 >10000 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
ATR serine/threonine kinase/Serine-protein kinase ATR in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5024] [GtoPdb: 1935] [UniProtKB: Q13535]
ChEMBL Inhibition of ATR (unknown origin) B 5.04 pIC50 >9100 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]
mechanistic target of rapamycin kinase/Serine/threonine-protein kinase mTOR in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2842] [GtoPdb: 2109] [UniProtKB: P42345]
ChEMBL Inhibition of mTOR (unknown origin) B 5.04 pIC50 >9100 nM IC50 Bioorg. Med. Chem. Lett. (2013) 23: 3741-3748 [PMID:23726034]

ChEMBL data shown on this page come from version 26:

Gaulton A, Hersey A, Nowotka M, Bento AP, Chambers J, Mendez D, Mutowo P, Atkinson F, Bellis LJ, CibriƔn-Uhalte E, Davies M, Dedman N, Karlsson A, MagariƱos MP, Overington JP, Papadatos G, Smit I, Leach AR. (2017) 'The ChEMBL database in 2017.' Nucleic Acids Res., 45(D1). DOI: 10.1093/nar/gkw1074. [PMCID:5210557]