Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY5R | Q15761 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.37 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | RAF1 | P04049 | 1/20 | 0.36 |
| ▸ | BRAF | P15056 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19706120 | 0.84 | POLB (0.45) | NPY5RKIF11TP53CA12CA1 | |
| SCHEMBL19706034 | 0.79 | ALDH1A1 (0.39) | RAB9AFYNPIK3CDPIK3CAPIK3CG | |
| SCHEMBL19365558 | 0.74 | KDR (0.40) | KIF11KDREPHB4LCKFYN | |
| SCHEMBL19365753 | 0.74 | CA12 (0.41) | TP53CA12CA1CA2CA9 | |
| SCHEMBL19365617 | 0.73 | KMO (0.39) | CA12CA1CA2CA9KDR | |
| SCHEMBL19670398 | 0.73 | CTSK (0.38) | CA12CA1CA2CA9EPHB4 | |
| SCHEMBL19365619 | 0.73 | KMO (0.37) | CA2CA9KDREPHB4PIK3CD | |
| SCHEMBL19365557 | 0.72 | MGLL (0.40) | EPHB4RAF1BRAF | |
| SCHEMBL19670450 | 0.72 | MEN1 (0.41) | CA12CA1CA2CA9EPHB4 | |
| SCHEMBL19670403 | 0.72 | BRAF (0.39) | KDREPHB4LCKFYNPIK3CD |
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 |