Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 17/20 | 1.00 |
| ▸ | NPC1 | O15118 | 2/20 | 0.64 |
| ▸ | MAPT | P10636 | 2/20 | 0.64 |
| ▸ | RAB9A | P51151 | 2/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.64 |
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.64 |
| ▸ | PIK3R1 | P27986 | 3/20 | 0.59 |
| ▸ | MTOR | P42345 | 3/20 | 0.59 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.58 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.58 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.58 |
| ▸ | PI4KA | P42356 | 3/20 | 0.52 |
| ▸ | PI4KB | Q9UBF8 | 3/20 | 0.52 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28617302 | 1.00 | PIK3CA (1.00) | PIK3CANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL29970161 | 0.91 | PIK3CA (0.83) | PIK3CANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL28600969 | 0.89 | PIK3CA (1.00) | PIK3CANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL29971056 | 0.89 | PIK3CA (0.84) | PIK3CANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL30012232 | 0.89 | PIK3CA (1.00) | PIK3CANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL30011161 | 0.89 | PIK3CA (1.00) | PIK3CANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL28614234 | 0.89 | PIK3CA (0.78) | PIK3CANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL30012022 | 0.89 | PIK3CA (0.78) | PIK3CANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL28602635 | 0.89 | PIK3CA (1.00) | PIK3CANPC1MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL25259671 | 0.83 | NPC1 (0.82) | PIK3CANPC1MAPTRAB9ASMN1; SMN2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113200969-B | PI3K alpha selective inhibitor and preparation method and application thereof | 中国药科大学 | 2022-11-25 | — | — | CN | disclosed |
| WO-2022242321-A1 | PI3Kα SELECTIVE INHIBITOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 中国药科大学 | 2022-11-24 | — | — | WO | disclosed |