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ChEMBL ligand: CHEMBL3702836 |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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ribosomal protein S6 kinase A3/Ribosomal protein S6 kinase alpha 3 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2345] [GtoPdb: 1528] [UniProtKB: P51812] | ||||||||
ChEMBL | Binding affinity to RPS6KA3 (unknown origin) | B | 9.27 | pKd | 0.54 | nM | Kd | Eur J Med Chem (2018) 151: 315-326 [PMID:29631132] |
Bruton tyrosine kinase/Tyrosine-protein kinase BTK in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5251] [GtoPdb: 1948] [UniProtKB: Q06187] | ||||||||
ChEMBL | Caliper-Based Kinase Assay: A Caliper-based kinase assay (Caliper Life Sciences, Hopkinton, Mass.) was used to measure inhibition of Btk kinase activity of a compound of the present disclosure. Serial dilutions of test compounds were incubated with human recombinant Btk (0.5 nM), ATP (16 μM) and a phosphoacceptor peptide substrate FAM-GEEPLYWSFPAKKK-NH2 (1 μM) at room temperature for 3 h. The reaction was then terminated with EDTA, final concentration 20 mM and the phosphorylated reaction product was quantified on a Caliper Desktop Profiler (Caliper LabChip 3000). | B | 8.68 | pIC50 | 2.1 | nM | IC50 | US-8940744-B2. Pyrazolopyrimidine compounds as kinase inhibitors (2015) |
ChEMBL | Caliper-Based Kinase Assay: A Caliper-based kinase assay (Caliper Life Sciences, Hopkinton, Mass.) was used to measure inhibition of Btk kinase activity of a compound of the present disclosure. Serial dilutions of test compounds were incubated with human recombinant Btk (0.5 nM), ATP (16 μM) and a phosphoacceptor peptide substrate FAM-GEEPLYWSFPAKKK-NH2 (1 μM) at room temperature for 3 h. The reaction was then terminated with EDTA, final concentration 20 mM and the phosphorylated reaction product was quantified on a Caliper Desktop Profiler (Caliper LabChip 3000). | B | 8.68 | pIC50 | 2.1 | nM | IC50 | US-9266895-B2. Substituted pyrazolo[3,4-d]pyrimidines as kinase inhibitors (2016) |
GtoPdb | - | - | 8.72 | pIC50 | 1.9 | nM | IC50 | Nat Chem Biol (2015) 11: 525-31 [PMID:26006010] |
ChEMBL | Inhibition of BTK (unknown origin) | B | 8.72 | pIC50 | 1.9 | nM | IC50 | Eur J Med Chem (2018) 151: 315-326 [PMID:29631132] |
erb-b2 receptor tyrosine kinase 4 in Human [GtoPdb: 1799] [UniProtKB: Q15303] | ||||||||
GtoPdb | - | - | 7.19 | pIC50 | 65 | nM | IC50 | Nat Chem Biol (2015) 11: 525-31 [PMID:26006010] |
BLK proto-oncogene, Src family tyrosine kinase in Human [GtoPdb: 1940] [UniProtKB: P51451] | ||||||||
GtoPdb | - | - | 7.17 | pIC50 | 68 | nM | IC50 | Nat Chem Biol (2015) 11: 525-31 [PMID:26006010] |
BMX non-receptor tyrosine kinase in Human [GtoPdb: 1942] [UniProtKB: P51813] | ||||||||
GtoPdb | - | - | 8.12 | pIC50 | 7.6 | nM | IC50 | Nat Chem Biol (2015) 11: 525-31 [PMID:26006010] |
tec protein tyrosine kinase in Human [GtoPdb: 2238] [UniProtKB: P42680] | ||||||||
GtoPdb | - | - | 8.47 | pIC50 | 3.4 | nM | IC50 | Nat Chem Biol (2015) 11: 525-31 [PMID:26006010] |
TXK tyrosine kinase in Human [GtoPdb: 2268] [UniProtKB: P42681] | ||||||||
GtoPdb | - | - | 7.39 | pIC50 | 41 | nM | IC50 | Nat Chem Biol (2015) 11: 525-31 [PMID:26006010] |
ChEMBL data shown on this page come from version 32:
Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]