Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3C3 | Q8NEB9 | 3/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | ATR | Q13535 | 3/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | PLK4 | O00444 | 1/20 | 0.32 |
| ▸ | IKBKB | O14920 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | JAK1 | P23458 | 1/20 | 0.31 |
| ▸ | TYK2 | P29597 | 1/20 | 0.31 |
| ▸ | JAK3 | P52333 | 1/20 | 0.31 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.31 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.31 |
| ▸ | BTK | Q06187 | 1/20 | 0.31 |
| ▸ | FPR2 | P25090 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19364825 | 0.91 | ATR (0.42) | PIK3C3HDAC1HDAC2HDAC3ATR | |
| SCHEMBL19670372 | 0.89 | HDAC1 (0.36) | HDAC1HDAC2HDAC3ABL1BTK | |
| SCHEMBL19365703 | 0.87 | PIK3C3 (0.40) | PIK3C3HDAC1HDAC2HDAC3ATR | |
| SCHEMBL19365778 | 0.87 | HDAC3 (0.39) | PIK3C3HDAC1HDAC2HDAC3ABL1 | |
| SCHEMBL19365567 | 0.87 | HDAC1 (0.43) | HDAC1HDAC2HDAC3ATRABL1 | |
| SCHEMBL19365798 | 0.87 | PIK3C3 (0.38) | PIK3C3HDAC1HDAC2HDAC3ATR | |
| SCHEMBL19365451 | 0.86 | GABRA1 (0.36) | HDAC1HDAC2HDAC3 | |
| SCHEMBL19706241 | 0.85 | HDAC2 (0.35) | HDAC1HDAC2HDAC3ATRBTK | |
| SCHEMBL19365325 | 0.83 | FAAH (0.36) | HDAC1HDAC2HDAC3BTKATM | |
| SCHEMBL19365702 | 0.83 | SCN10A (0.34) | PIK3C3HDAC2ATRPIK3CGPIK3CD |
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-9765075-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-09-19 | — | — | US | disclosed |