BDBM36408 1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine, PP494::CID24905153
SMILES: COc1ccc(cc1OC)-c1nn(C2CCC2)c2ncnc(N)c12
InChI Key: InChIKey=ITOYZJGFTNTKKR-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description Inhibition of PI3K enzyme activity is measured in a microtiter plate-based fluorescence polarization (FP) assay. | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
PI3K-alpha/ p110-beta (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description Inhibition of PI3K enzyme activity is measured in a microtiter plate-based fluorescence polarization (FP) assay. | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
PI3K-alpha/ p110-delta (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description Inhibition of PI3K enzyme activity is measured in a microtiter plate-based fluorescence polarization (FP) assay. | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
PI3K-alpha/ p110-beta (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 72 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description Inhibition of PI3K enzyme activity is measured in a microtiter plate-based fluorescence polarization (FP) assay. | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
PI3K-alpha/ DNA-PK (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 47 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description Inhibition of PI3K enzyme activity is measured in a microtiter plate-based fluorescence polarization (FP) assay. | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
PI3K-alpha/ mTOR (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 1.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description Inhibition of PI3K enzyme activity is measured in a microtiter plate-based fluorescence polarization (FP) assay. | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
PI3K-alpha/ PDGFR (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 170 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description The assays were performed in 96-well microtiter plates that had been coated with a polyGluTyr peptide. Negative control wells received buffer alone w... | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
PI3K-alpha/ Hck (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description The assays were performed in 96-well microtiter plates that had been coated with a polyGluTyr peptide. Negative control wells received buffer alone w... | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
PI3K-alpha/ Src (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | PDB Article PubMed | n/a | n/a | 170 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description The assays were performed in 96-well microtiter plates that had been coated with a polyGluTyr peptide. Negative control wells received buffer alone w... | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
PI3K-alpha/ Src Mutant (T338I) (Homo sapiens (Human)-Gallus gallus (Chicken)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | PDB Article PubMed | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description The assays were performed in 96-well microtiter plates that had been coated with a polyGluTyr peptide. Negative control wells received buffer alone w... | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
PI3K-alpha/ VEGFR2 (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 7.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description The assays were performed in 96-well microtiter plates that had been coated with a polyGluTyr peptide. Negative control wells received buffer alone w... | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
PI3K-alpha/ EGFR (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description The assays were performed in 96-well microtiter plates that had been coated with a polyGluTyr peptide. Negative control wells received buffer alone w... | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
PI3K-alpha/ EphB4 (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description The assays were performed in 96-well microtiter plates that had been coated with a polyGluTyr peptide. Negative control wells received buffer alone w... | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
PI3K-alpha/ Abl (Homo sapiens (Human)) | BDBM36408 (1-cyclobutyl-3-(3,4-dimethoxyphenyl)-1H-pyrazolo[3...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet | DrugBank MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
University of California, San Francisco | Assay Description The assays were performed in 96-well microtiter plates that had been coated with a polyGluTyr peptide. Negative control wells received buffer alone w... | Nat Chem Biol 4: 691-9 (2008) Article DOI: 10.1038/nchembio.117 BindingDB Entry DOI: 10.7270/Q2NP22S9 | |||||||||||
More data for this Ligand-Target Pair |