Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 18/20 | 0.52 |
| ▸ | MTOR | P42345 | 18/20 | 0.52 |
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.42 |
| ▸ | FEN1 | P39748 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6890798 | 0.88 | PIK3CA (0.50) | PIK3CAMTOR | |
| SCHEMBL6894184 | 0.86 | PIK3CA (0.48) | PIK3CAMTORALOX5APFEN1 | |
| SCHEMBL12138100 | 0.85 | DHFR (0.54) | PIK3CAMTORDHFRALOX5APFEN1 | |
| SCHEMBL10158390 | 0.85 | PIK3CA (0.71) | PIK3CAMTOR | |
| SCHEMBL10157564 | 0.84 | PIK3CA (0.55) | PIK3CAMTOR | |
| SCHEMBL6892259 | 0.83 | PIK3CA (0.57) | PIK3CAMTOR | |
| SCHEMBL6892332 | 0.83 | PIK3CA (0.59) | PIK3CAMTOR | |
| SCHEMBL6892408 | 0.83 | PIK3CA (0.56) | PIK3CAMTOR | |
| SCHEMBL6893262 | 0.83 | PIK3CA (0.54) | PIK3CAMTOR | |
| SCHEMBL515738 | 0.82 | PIK3CA (0.76) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011092198-A1 | 5-ALKYNYL-PYRIMIDINES | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-08-04 | — | — | WO | disclosed |