Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K12 | Q12852 | 4/20 | 0.41 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.30 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22239462 | 0.79 | PDE4B (0.33) | MAP3K12 | |
| SCHEMBL16220399 | 0.77 | TRPV3 (0.41) | MAP3K12 | |
| SCHEMBL31568039 | 0.68 | GSK3A (0.39) | — | |
| SCHEMBL16220100 | 0.65 | CNR2 (0.32) | — | |
| SCHEMBL1616409 | 0.65 | MAPT (0.43) | MAP3K12PIK3CA | |
| SCHEMBL855517 | 0.65 | PIK3CA (0.38) | PIK3CAMTOR | |
| SCHEMBL23073961 | 0.64 | HSD11B1 (0.39) | — | |
| SCHEMBL13592662 | 0.64 | HSD11B1 (0.39) | — | |
| SCHEMBL16212243 | 0.64 | MAP3K12 (0.37) | MAP3K12 | |
| SCHEMBL19894137 | 0.63 | PDE10A (0.43) | — |
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-2991977-B1 | C-LINKED HETEROCYCLOALKYL SUBSTITUTED PYRIMIDINES AND THEIR USES | HOFFMANN LA ROCHE (CH) | 2020-07-22 | — | — | EP | disclosed |