Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 17/20 | 0.46 |
| ▸ | MTOR | P42345 | 17/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6896549 | 0.83 | PIK3CA (0.44) | PIK3CAMTOR | |
| SCHEMBL6894053 | 0.81 | PIK3CD (0.50) | PIK3CAMTORPIK3CD | |
| SCHEMBL12138095 | 0.81 | DHFR (0.52) | PIK3CD | |
| SCHEMBL6893238 | 0.79 | PIK3CA (0.40) | PIK3CAMTOR | |
| SCHEMBL7879430 | 0.79 | PIK3CD (0.45) | PIK3CAMTORPIK3CD | |
| SCHEMBL6894557 | 0.78 | PIK3CG (0.42) | PIK3CAMTORPIK3CD | |
| SCHEMBL10157862 | 0.78 | PIK3CA (0.62) | PIK3CAMTOR | |
| SCHEMBL10157585 | 0.77 | PIK3CA (0.67) | PIK3CAMTOR | |
| SCHEMBL10197834 | 0.75 | PIK3CA (0.62) | PIK3CAMTOR | |
| SCHEMBL6892477 | 0.74 | PIK3CA (0.50) | PIK3CAMTOR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011092197-A1 | 5-ALKYNYL PYRIMIDINES AND THEIR USE AS KINASE INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-08-04 | — | — | WO | disclosed |
| WO-2011092198-A1 | 5-ALKYNYL-PYRIMIDINES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-08-04 | — | — | WO | disclosed |