Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 11/20 | 0.54 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.54 |
| ▸ | CLK2 | P49760 | 1/20 | 0.54 |
| ▸ | BLK | P51451 | 1/20 | 0.54 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.54 |
| ▸ | STK3 | Q13188 | 1/20 | 0.54 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.54 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.54 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.54 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.54 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.45 |
| ▸ | MET | P08581 | 1/20 | 0.45 |
| ▸ | SLC2A1 | P11166 | 7/20 | 0.44 |
| ▸ | SLC2A3 | P11169 | 7/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3797550 | 0.92 | ROCK2 (0.50) | ROCK2ROCK1CLK2BLKCSNK2A1 | |
| SCHEMBL4780560 | 0.89 | ERBB2 (0.47) | ROCK2ROCK1CLK2BLKCSNK2A1 | |
| SCHEMBL878171 | 0.87 | FGFR1 (0.52) | ROCK2AURKBPRKD3METABCB1 | |
| SCHEMBL877653 | 0.87 | ROCK2 (0.45) | ROCK2AURKBPRKD3METABCB1 | |
| SCHEMBL877096 | 0.87 | ROCK2 (0.71) | ROCK2ROCK1CLK2BLKCSNK2A1 | |
| SCHEMBL30915548 | 0.87 | ROCK2 (0.71) | ROCK2ROCK1CLK2BLKCSNK2A1 | |
| SCHEMBL876538 | 0.85 | ROCK2 (0.74) | ROCK2ROCK1CLK2BLKCSNK2A1 | |
| SCHEMBL877813 | 0.84 | ABCG2 (0.54) | ABCB1ABCG2 | |
| SCHEMBL877814 | 0.84 | ABCG2 (0.54) | ABCB1ABCG2 | |
| SCHEMBL13186724 | 0.84 | ROCK2 (0.47) | ROCK2ROCK1CLK2BLKCSNK2A1 |
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-2012040499-A2 | METABOLIC INHIBITORS | SURFACE LOGIX, INC. (US) | 2012-03-29 | — | — | WO | disclosed |