Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 12/20 | 0.46 |
| ▸ | MTOR | P42345 | 12/20 | 0.46 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18032505 | 0.95 | HRH3 (0.55) | HRH3SMN1; SMN2PIK3CAMTORPIK3CG | |
| SCHEMBL4752524 | 0.84 | SMN1; SMN2 (0.52) | HRH3SMN1; SMN2PIK3CAPIK3CG | |
| SCHEMBL4789881 | 0.81 | SMN1; SMN2 (0.43) | HRH3SMN1; SMN2PIK3CAMTOR | |
| SCHEMBL13982364 | 0.80 | SMN1; SMN2 (0.48) | HRH3SMN1; SMN2PIK3CAMTOR | |
| SCHEMBL390035 | 0.78 | PIK3CD (0.53) | HRH3PIK3CAPIK3CG | |
| SCHEMBL4754666 | 0.78 | PIK3CA (0.65) | PIK3CAMTORPIK3CG | |
| SCHEMBL13982563 | 0.76 | PIK3CA (0.52) | PIK3CAMTORPIK3CG | |
| SCHEMBL13982367 | 0.76 | SMN1; SMN2 (0.42) | SMN1; SMN2PIK3CAMTORPIK3CG | |
| SCHEMBL3776763 | 0.74 | SMN1; SMN2 (0.61) | SMN1; SMN2PIK3CA | |
| SCHEMBL996677 | 0.74 | PIK3CD (0.56) | HRH3PIK3CAPIK3CG |
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-2008152387-A1 | QUINAZOLINE DERIVATIVES AS PI3 KINASE INHIBITORS | F.HOFFMANN-LA ROCHE AG (CH) | 2008-12-18 | — | — | WO | disclosed |