Reaction Details | |||
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Target | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform | ||
Ligand | BDBM50433048 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_955790 (CHEMBL2379607) | ||
Ki | 3.4±n/a nM | ||
Citation | Cheng, H; Hoffman, JE; Le, PT; Pairish, M; Kania, R; Farrell, W; Bagrodia, S; Yuan, J; Sun, S; Zhang, E; Xiang, C; Dalvie, D; Rahavendran, SV Structure-based design, SAR analysis and antitumor activity of PI3K/mTOR dual inhibitors from 4-methylpyridopyrimidinone series. Bioorg Med Chem Lett23:2787-92 (2013) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform | |||
Name: | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform | ||
Synonyms: | PI3-kinase p110 subunit alpha | PI3-kinase p110-alpha subunit | PI3K | PK3CA_MOUSE | Phosphatidylinositol 3-kinase p110α (p110α) | Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (PI3K alpha) | Phosphatidylinositol-4,5-bisphosphate 3-kinase catalytic subunit alpha isoform | Pik3ca | PtdIns-3-kinase p110 | ||
Type: | Protein | ||
Mol. Mass.: | 124421.84 | ||
Organism: | Mus musculus (Mouse) | ||
Description: | P42337 | ||
Residue: | 1068 | ||
Sequence: |
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BDBM50433048 | |||
n/a | |||
Name | BDBM50433048 | ||
Synonyms: | CHEMBL2375967 | ||
Type | Small organic molecule | ||
Emp. Form. | C18H22N6O3 | ||
Mol. Mass. | 370.4057 | ||
SMILES | Cc1nc(N)nc2n([C@H]3CC[C@@H](CC3)OCO)c(=O)c(cc12)-c1cn[nH]c1 |r,wU:11.14,wD:8.7,(43.23,-15.53,;43.23,-17.07,;41.9,-17.84,;41.9,-19.39,;40.57,-20.15,;43.23,-20.16,;44.56,-19.39,;45.9,-20.17,;45.89,-21.7,;44.56,-22.47,;44.55,-24,;45.88,-24.78,;47.21,-24.02,;47.23,-22.47,;45.87,-26.32,;44.53,-27.08,;43.2,-26.3,;47.25,-19.39,;48.58,-20.17,;47.25,-17.84,;45.91,-17.05,;44.57,-17.83,;48.59,-17.08,;49.98,-17.72,;51.02,-16.59,;50.26,-15.25,;48.76,-15.56,)| | ||
Structure |