Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 6/20 | 0.37 |
| ▸ | PIK3C3 | Q8NEB9 | 3/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | ENPP3 | O14638 | 2/20 | 0.34 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4584711 | 0.90 | PIK3C3 (0.40) | CYP2C19HTR6PIK3C3HDAC3HDAC4 | |
| SCHEMBL4582735 | 0.89 | CYP2C19 (0.41) | CYP2C19HTR6PIK3C3METHDAC3 | |
| SCHEMBL4582484 | 0.87 | CYP2C19 (0.39) | CYP2C19HTR6PIK3C3DRD2HTR2A | |
| SCHEMBL4612732 | 0.81 | PIK3C3 (0.42) | CYP2C19HTR6PIK3C3HDAC3HDAC4 | |
| SCHEMBL8242820 | 0.81 | PIK3C3 (0.40) | CYP2C19HTR6PIK3C3HDAC3HDAC4 | |
| SCHEMBL4591926 | 0.77 | AKT1 (0.43) | CYP2C19HTR6PIK3C3METHDAC3 | |
| SCHEMBL4633196 | 0.76 | CYP2C19 (0.46) | CYP2C19HTR6PIK3C3METENPP3 | |
| SCHEMBL27848203 | 0.75 | CYP2C19 (0.45) | CYP2C19HTR6PIK3C3METHDAC3 | |
| SCHEMBL29941031 | 0.73 | CYP2C19 (0.58) | CYP2C19HTR6METHDAC3HDAC4 | |
| SCHEMBL457569 | 0.73 | CYP2C19 (0.58) | CYP2C19HTR6METHDAC3HDAC4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1968568-A2 | INHIBITORS OF Akt ACTIVITY | SmithKline Beecham Corporation (US) | 2008-09-17 | — | — | EP | disclosed |
| WO-2007076423-A2 | INHIBITORS OF Akt ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2007-07-05 | — | — | WO | disclosed |