Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KA5 | O75582 | 10/20 | 0.51 |
| ▸ | AKT1 | P31749 | 9/20 | 0.51 |
| ▸ | RPS6KA1 | Q15418 | 7/20 | 0.51 |
| ▸ | ROCK1 | Q13464 | 9/20 | 0.44 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4246418 | 0.86 | AKT1 (0.46) | RPS6KA5AKT1RPS6KA1ROCK1SLC2A1 | |
| SCHEMBL4071929 | 0.82 | RPS6KA5 (0.55) | RPS6KA5AKT1RPS6KA1ROCK1SLC2A1 | |
| SCHEMBL4239053 | 0.81 | RPS6KA5 (0.53) | RPS6KA5AKT1RPS6KA1ROCK1SLC2A1 | |
| SCHEMBL5067604 | 0.80 | RPS6KA5 (0.56) | RPS6KA5AKT1RPS6KA1ROCK1SLC2A1 | |
| SCHEMBL4243398 | 0.79 | RPS6KA5 (0.53) | RPS6KA5AKT1RPS6KA1ROCK1SLC2A1 | |
| Hydrochloric Acid SCHEMBL5062655 | 0.78 | RPS6KA5 (0.54) | RPS6KA5AKT1RPS6KA1ROCK1SLC2A1 | |
| Trifluoroacetic Acid SCHEMBL5067615 | 0.77 | AKT1 (0.72) | RPS6KA5AKT1RPS6KA1ROCK1SLC2A1 | |
| SCHEMBL4068592 | 0.77 | AKT1 (0.81) | RPS6KA5AKT1RPS6KA1ROCK1SLC2A1 | |
| Trifluoroacetic Acid SCHEMBL5066192 | 0.77 | AKT1 (0.69) | RPS6KA5AKT1RPS6KA1ROCK1SLC2A1 | |
| SCHEMBL4065312 | 0.77 | AKT1 (0.77) | RPS6KA5AKT1RPS6KA1ROCK1SLC2A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1653961-A4 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORP (US) | 2009-04-01 | — | — | EP | disclosed |
| EP-1653961-A1 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2006-05-10 | — | — | EP | disclosed |
| WO-2005011700-A1 | INHIBITORS OF Akt ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2005-02-10 | — | — | WO | disclosed |