Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 8/20 | 0.46 |
| ▸ | MTOR | P42345 | 8/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 6/20 | 0.46 |
| ▸ | PIK3CG | P48736 | 6/20 | 0.46 |
| ▸ | PIK3CB | P42338 | 5/20 | 0.46 |
| ▸ | AKT1 | P31749 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.39 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14783938 | 1.00 | PIK3CA (0.46) | PIK3CAMTORPIK3CDPIK3CGPIK3CB | |
| SCHEMBL14783379 | 0.92 | PIK3CA (0.46) | PIK3CAMTORPIK3CDPIK3CGPIK3CB | |
| SCHEMBL29592442 | 0.92 | PIK3CA (0.46) | PIK3CAMTORPIK3CDPIK3CGPIK3CB | |
| SCHEMBL14783124 | 0.91 | IDH2 (0.49) | AKT1 | |
| SCHEMBL29590150 | 0.91 | IDH2 (0.49) | AKT1 | |
| SCHEMBL15619687 | 0.90 | PIK3CA (0.44) | PIK3CAMTORPIK3CDPIK3CGPIK3CB | |
| SCHEMBL14783129 | 0.90 | PIK3CA (0.47) | PIK3CAMTORPIK3CDPIK3CGPIK3CB | |
| SCHEMBL29590134 | 0.90 | PIK3CA (0.47) | PIK3CAMTORPIK3CDPIK3CGPIK3CB | |
| SCHEMBL15689190 | 0.90 | PIK3CA (0.52) | PIK3CAMTORPIK3CDPIK3CGPIK3CB | |
| SCHEMBL14783980 | 0.89 | PIK3CA (0.44) | PIK3CAMTORPIK3CDPIK3CGPIK3CB |
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-115403531-A | Chemical entities, compositions, and methods as kinase inhibitors | 润新生物公司 | 2022-11-29 | — | — | CN | disclosed |
| CN-108794411-B | Certain chemical entities, compositions, and methods | 润新生物公司 | 2022-06-07 | — | — | CN | disclosed |