Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | RHOA | P61586 | 2/20 | 0.39 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | WNT1 | P04628 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.39 |
| ▸ | CCR3 | P51677 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 3/20 | 0.38 |
| ▸ | BRD4 | O60885 | 2/20 | 0.38 |
| ▸ | CASR | P41180 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.36 |
| ▸ | NCF1 | P14598 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16785510 | 0.87 | BRAF (0.41) | BRAFRHOALIMK2CNR1WNT1 | |
| SCHEMBL17624674 | 0.87 | BRAF (0.41) | BRAFRHOALIMK2CNR1WNT1 | |
| SCHEMBL16249971 | 0.86 | CNR1 (0.42) | BRAFRHOALIMK2CNR1CCR3 | |
| SCHEMBL16776052 | 0.86 | CREBBP (0.43) | BRAFRHOALIMK2CNR1WNT1 | |
| SCHEMBL19865026 | 0.86 | CNR1 (0.42) | BRAFRHOALIMK2CNR1CCR3 | |
| SCHEMBL19365415 | 0.85 | BRAF (0.41) | BRAFRHOALIMK2CNR1WNT1 | |
| SCHEMBL19670332 | 0.83 | BRAF (0.41) | BRAFRHOALIMK2WNT1GSK3B | |
| SCHEMBL19365543 | 0.81 | BRAF (0.43) | BRAFRHOALIMK2CNR1GSK3B | |
| SCHEMBL19865057 | 0.79 | RHOA (0.41) | BRAFRHOAWNT1GSK3BDYRK1A | |
| SCHEMBL19670660 | 0.78 | HDAC3 (0.37) | BRAFRHOAWNT1GSK3BDYRK1A |
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 |
|---|---|---|---|---|---|---|---|
| US-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |