Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.61 |
| ▸ | BRAF | P15056 | 19/20 | 0.57 |
| ▸ | RAF1 | P04049 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL3594964 | 0.79 | PKM (0.64) | PKMBRAFRAF1 | |
| SCHEMBL3596236 | 0.78 | PKM (0.69) | PKMBRAF | |
| SCHEMBL3587501 | 0.77 | PKM (0.66) | PKMBRAFRAF1 | |
| SCHEMBL3595578 | 0.76 | BRAF (0.63) | PKMBRAFRAF1 | |
| SCHEMBL14138688 | 0.76 | PKM (0.79) | PKMBRAFRAF1 | |
| SCHEMBL3638755 | 0.76 | PKM (0.65) | PKMBRAFRAF1 | |
| SCHEMBL3593491 | 0.76 | BRAF (0.59) | PKMBRAF | |
| SCHEMBL3593583 | 0.75 | PKM (0.64) | PKMBRAF | |
| SCHEMBL3589819 | 0.75 | BRAF (0.61) | PKMBRAF | |
| SCHEMBL3593897 | 0.75 | PKM (0.61) | PKMBRAFRAF1 |
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-2008079277-A1 | CERTAIN PYRAZOLINE DERIVATIVES WITH KINASE INHIBITORY ACTIVITY | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2008-07-03 | — | — | WO | disclosed |