Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 12/20 | 0.46 |
| ▸ | MTOR | P42345 | 3/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3R2 | O00459 | 1/20 | 0.39 |
| ▸ | PIK3R5 | Q8WYR1 | 1/20 | 0.39 |
| ▸ | PIK3R3 | Q92569 | 1/20 | 0.39 |
| ▸ | PLK4 | O00444 | 3/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.37 |
| ▸ | NTRK3 | Q16288 | 3/20 | 0.37 |
| ▸ | NTRK2 | Q16620 | 3/20 | 0.37 |
| ▸ | PAK4 | O96013 | 1/20 | 0.37 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.37 |
| ▸ | PIK3R1 | P27986 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19623649 | 0.88 | VNN1 (0.43) | PIK3CAMTORPIK3CBPIK3CG | |
| SCHEMBL19623825 | 0.81 | PIK3CA (0.55) | PIK3CAPIK3CBPIK3CG | |
| SCHEMBL2376085 | 0.81 | PIK3CA (0.70) | PIK3CAMTOR | |
| SCHEMBL19623809 | 0.79 | PIK3CA (0.52) | PIK3CAPIK3CBPIK3CG | |
| SCHEMBL19623596 | 0.77 | PIK3CA (0.51) | PIK3CAMTORPIK3CBPIK3CG | |
| SCHEMBL12247595 | 0.76 | PIK3CA (0.65) | PIK3CAMTORPIK3R1 | |
| SCHEMBL3835911 | 0.76 | PIK3CA (0.72) | PIK3CA | |
| Trifluoroacetic Acid SCHEMBL2376933 | 0.73 | PIK3CA (0.59) | PIK3CAMTORPIK3R1 | |
| Trifluoroacetic Acid SCHEMBL2375817 | 0.72 | PIK3CA (0.66) | PIK3CA | |
| SCHEMBL12247607 | 0.72 | PIK3CA (0.76) | PIK3CA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2050749-B1 | PYRIMIDINE DERIVATIVE AS PI3K INHIBITOR AND USE THEREOF | CHUGAI PHARMACEUTICAL CO LTD (JP) | 2017-11-22 | — | — | EP | disclosed |