Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | RHOA | P61586 | 2/20 | 0.40 |
| ▸ | CASR | P41180 | 1/20 | 0.40 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 2/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 2/20 | 0.37 |
| ▸ | NCF1 | P14598 | 1/20 | 0.36 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.36 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19706060 | 0.88 | BRAF (0.42) | BRAFGSK3BDYRK1ARHOACASR | |
| SCHEMBL19706031 | 0.86 | CASR (0.44) | BRAFRHOACASRLIMK2CNR1 | |
| SCHEMBL19365806 | 0.81 | RHOA (0.42) | BRAFGSK3BDYRK1ARHOACASR | |
| SCHEMBL19365577 | 0.79 | GRM5 (0.38) | ATR | |
| SCHEMBL19670445 | 0.78 | GRM5 (0.39) | ATR | |
| SCHEMBL19365668 | 0.78 | BRAF (0.43) | BRAFRHOACASRCNR1ATR | |
| SCHEMBL19365833 | 0.78 | RHOA (0.43) | BRAFRHOACASRBRD4CREBBP | |
| SCHEMBL19670283 | 0.77 | RAB9A (0.39) | RAB9A | |
| SCHEMBL19365843 | 0.77 | RHOA (0.39) | BRAFGSK3BDYRK1ARHOACASR | |
| SCHEMBL19706136 | 0.77 | RHOA (0.43) | BRAFRHOACASRLIMK2BRD4 |
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 |