duvelisib [Ligand Id: 7795] activity data from GtoPdb and ChEMBL

Click here for a description of the charts and data table

Please tell us if you are using this feature and what you think!

ChEMBL ligand: CHEMBL3039502 (INK-1197, IPI-145, INK-1147, Duvelisib, Copiktra)
  • phosphoinositide-3-kinase regulatory subunit 1/phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit alpha/PI3-kinase p110-alpha/p85-alpha in Human [ChEMBL: CHEMBL2111367] [GtoPdb: 25032153] [UniProtKB: P27986P42336]
There should be some charts here, you may need to enable JavaScript!
  • phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit alpha/PI3-kinase p110-alpha subunit in Human [ChEMBL: CHEMBL4005] [GtoPdb: 2153] [UniProtKB: P42336]
There should be some charts here, you may need to enable JavaScript!
  • phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit beta/PI3-kinase p110-beta subunit in Human [ChEMBL: CHEMBL3145] [GtoPdb: 2154] [UniProtKB: P42338]
There should be some charts here, you may need to enable JavaScript!
  • phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit delta/phosphoinositide-3-kinase regulatory subunit 1/PI3-kinase p110-delta/p85-alpha in Human [ChEMBL: CHEMBL2111432] [GtoPdb: 21552503] [UniProtKB: O00329P27986]
There should be some charts here, you may need to enable JavaScript!
  • phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit delta/PI3-kinase p110-delta subunit in Human [ChEMBL: CHEMBL3130] [GtoPdb: 2155] [UniProtKB: O00329]
There should be some charts here, you may need to enable JavaScript!
  • phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit gamma/PI3-kinase p110-gamma subunit in Human [ChEMBL: CHEMBL3267] [GtoPdb: 2156] [UniProtKB: P48736]
There should be some charts here, you may need to enable JavaScript!
  • phosphoinositide-3-kinase regulatory subunit 1/phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit beta/PI3K p110 beta/p85 alpha in Human [ChEMBL: CHEMBL3038510] [GtoPdb: 25032154] [UniProtKB: P27986P42338]
There should be some charts here, you may need to enable JavaScript!
DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
phosphoinositide-3-kinase regulatory subunit 1/phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit alpha/PI3-kinase p110-alpha/p85-alpha in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL2111367] [GtoPdb: 25032153] [UniProtKB: P27986P42336]
ChEMBL Inhibition of N-terminal His6-tagged recombinant full-length human p110alpha/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf21 cells using phosphatidylinositol as substrate in presence of gamma-32P-ATP after 5 mins by thin layer chromatographic method B 5 pIC50 <10000 nM IC50 US-8193182-B2. Substituted isoquinolin-1(2H)-ones, and methods of use thereof (2012)
GtoPdb - - 5.8 pIC50 1602 nM IC50 Chem Biol (2013) 20: 1364-74 [PMID:24211136]
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 PI3Kalpha (unknown origin) B 5.8 pIC50 1602 nM IC50 Eur J Med Chem (2019) 163: 413-427 [PMID:30530193]
GtoPdb - - 5.8 pIC50 1602 nM IC50 Chem Biol (2013) 20: 1364-74 [PMID:24211136]
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]
GtoPdb - - 7.07 pIC50 85 nM IC50 Chem Biol (2013) 20: 1364-74 [PMID:24211136]
ChEMBL Inhibition of PI3Kbeta (unknown origin) B 7.07 pIC50 85 nM IC50 Eur J Med Chem (2019) 163: 413-427 [PMID:30530193]
phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit delta/phosphoinositide-3-kinase regulatory subunit 1/PI3-kinase p110-delta/p85-alpha in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL2111432] [GtoPdb: 21552503] [UniProtKB: O00329P27986]
ChEMBL Inhibition of N-terminal His6-tagged recombinant full-length human p110delta/untagged recombinant full length p85alpha expressed in baculovirus infected Sf21 cells using phosphatidylinositol as substrate in presence of gamma-32P-ATP after 5 mins by thin layer chromatographic method B 7 pIC50 <100 nM IC50 US-8193182-B2. Substituted isoquinolin-1(2H)-ones, and methods of use thereof (2012)
GtoPdb - - 8.6 pIC50 2.5 nM IC50 Chem Biol (2013) 20: 1364-74 [PMID:24211136]
ChEMBL Inhibition of PI3KCdelta/PIK3R1 (unknown origin) B 8.64 pIC50 2.3 nM IC50 Eur J Med Chem (2018) 158: 405-413 [PMID:30237123]
ChEMBL Inhibition of N-terminal His6-tagged recombinant full length human p110delta/untagged recombinant full length human p85alpha expressed in baculovirus infected Sf21 insect cells using PIP2 as substrate measured after 80 mins by transcreener fluorescence polarization assay B 9 pIC50 1 nM IC50 J Med Chem (2019) 62: 4936-4948 [PMID:31033293]
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 PI3Kdelta in human whole blood assessed as reduction in fMLP-stimulated CD63 expression in basophils preincubated for 30 mins followed by fMLP stimulation B 5.66 pIC50 2206 nM IC50 J Med Chem (2019) 62: 4936-4948 [PMID:31033293]
ChEMBL Inhibition of PI3Kdelta (unknown origin) B 7.57 pIC50 27 nM IC50 Eur J Med Chem (2019) 163: 413-427 [PMID:30530193]
ChEMBL Inhibition of PI3Kdelta in human whole blood assessed as reduction in anti-IgM-stimulated CD69 expression on B-cells preincubated for 60 mins followed by anti-IgM stimulation and measured after overnight incubation by flow cytometry B 7.85 pIC50 14 nM IC50 J Med Chem (2019) 62: 4936-4948 [PMID:31033293]
GtoPdb - - 8.6 pIC50 2.5 nM IC50 Chem Biol (2013) 20: 1364-74 [PMID:24211136]
ChEMBL Inhibition of PI3Kdelta in human Raji cells B 8.6 pIC50 2.5 nM IC50 J Med Chem (2019) 62: 4783-4814 [PMID:30582813]
ChEMBL Inhibition of PI3Kdelta in human Ramos cells assessed as reduction in antihuman IgM-stimulated AKT phosphorylation at Ser473 residue preincubated for 60 mins followed by antihuman IgM stimulation and measured after 15 mins B 9 pIC50 1 nM IC50 J Med Chem (2019) 62: 4936-4948 [PMID:31033293]
ChEMBL Inhibition of human PI3Kdelta (R108 to Q1044 residues) expressed in mammalian expression system incubated for 60 mins by ADAPTA assay B 9.3 pIC50 <0.5 nM IC50 ACS Med Chem Lett (2016) 7: 908-912 [PMID:27774127]
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]
ChEMBL Inhibition of recombinant human C-terminal His6-tagged p110gamma expressed in insect cells using phosphatidylinositol as substrate in presence of gamma-32P-ATP after 5 mins by thin layer chromatographic method B 7 pIC50 <100 nM IC50 US-8193182-B2. Substituted isoquinolin-1(2H)-ones, and methods of use thereof (2012)
ChEMBL Inhibition of PI3Kgamma in human Raji cells B 7.57 pIC50 27 nM IC50 J Med Chem (2019) 62: 4783-4814 [PMID:30582813]
GtoPdb - - 7.57 pIC50 27 nM IC50 Chem Biol (2013) 20: 1364-74 [PMID:24211136]
ChEMBL Inhibition of PI3Kgamma in human whole blood assessed as reduction in anti-IgE-stimulated CD63 expression in basophils preincubated for 30 mins followed by anti-IgE stimulation B 7.82 pIC50 15 nM IC50 J Med Chem (2019) 62: 4936-4948 [PMID:31033293]
ChEMBL Inhibition of PI3KCgamma (unknown origin) B 7.92 pIC50 12 nM IC50 Eur J Med Chem (2018) 158: 405-413 [PMID:30237123]
ChEMBL Inhibition of human PI3Kgamma (S144 to A1102 residues) expressed in mammalian expression system incubated for 60 mins by ADAPTA assay B 8.54 pIC50 2.9 nM IC50 ACS Med Chem Lett (2016) 7: 908-912 [PMID:27774127]
ChEMBL Inhibition of PI3Kgamma (unknown origin) B 8.6 pIC50 2.5 nM IC50 Eur J Med Chem (2019) 163: 413-427 [PMID:30530193]
ChEMBL Inhibition of recombinant human full-length His-tagged PI3K p110gamma expressed in baculovirus expression system using PIP2 as substrate measured after 80 mins by transcreener fluorescence polarization assay B 8.7 pIC50 2 nM IC50 J Med Chem (2019) 62: 4936-4948 [PMID:31033293]
phosphoinositide-3-kinase regulatory subunit 1/phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit beta/PI3K p110 beta/p85 alpha in Human (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL3038510] [GtoPdb: 25032154] [UniProtKB: P27986P42338]
ChEMBL Inhibition of N-terminal His6-tagged recombinant full-length human p110beta/untagged recombinant full length p85alpha expressed in baculovirus infected Sf21 cells using phosphatidylinositol as substrate in presence of gamma-32P-ATP after 5 mins by thin layer chromatographic method B 6 pIC50 <1000 nM IC50 US-8193182-B2. Substituted isoquinolin-1(2H)-ones, and methods of use thereof (2012)
GtoPdb - - 7.07 pIC50 85 nM IC50 Chem Biol (2013) 20: 1364-74 [PMID:24211136]

ChEMBL data shown on this page come from version 28:

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]