Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 5/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | PIK3R1 | P27986 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MTOR | P42345 | 3/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.39 |
| ▸ | PIK3C2B | O00750 | 2/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.39 |
| ▸ | PIK3C3 | Q8NEB9 | 2/20 | 0.39 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1308905 | 0.82 | MAPT (0.61) | PIK3CAMAPTL3MBTL1PIK3R1MEN1 | |
| SCHEMBL38827 | 0.78 | MAPT (0.57) | PIK3CAMAPTL3MBTL1PIK3R1MEN1 | |
| SCHEMBL28998051 | 0.77 | ALDH1A1 (0.59) | PIK3CAMAPTL3MBTL1PIK3R1TSHR | |
| SCHEMBL8801187 | 0.76 | PIK3CA (0.47) | PIK3CAMAPTL3MBTL1TSHRMEN1 | |
| SCHEMBL28998047 | 0.75 | ALDH1A1 (0.62) | MAPTL3MBTL1TSHRMEN1KMT2A | |
| SCHEMBL1409330 | 0.74 | MTOR (0.51) | PIK3CAMAPTL3MBTL1TSHRMEN1 | |
| SCHEMBL1408578 | 0.73 | PIK3CA (0.52) | PIK3CAMAPTL3MBTL1MEN1KMT2A | |
| SCHEMBL29880240 | 0.73 | PIK3CA (0.52) | PIK3CAMAPTL3MBTL1MEN1KMT2A | |
| SCHEMBL1310780 | 0.72 | MAPT (0.60) | PIK3CAMAPTL3MBTL1PIK3R1MEN1 | |
| SCHEMBL20692823 | 0.72 | MAPT (0.52) | PIK3CAMAPTL3MBTL1PIK3R1MEN1 |
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 3 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 |
| CN-113200969-A | PI3K alpha selective inhibitor and preparation method and application thereof | 中国药科大学 | 2021-08-03 | — | — | CN | disclosed |