Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | RECQL | P46063 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4073210 | 0.85 | CYP3A4 (0.46) | CYP3A4CYP1A2RECQLMAPK1CYP2C9 | |
| SCHEMBL1273081 | 0.85 | CYP3A4 (0.46) | CYP3A4CYP1A2RECQLMAPK1CYP2C9 | |
| SCHEMBL16757585 | 0.83 | CYP2C9 (0.44) | CYP3A4CYP1A2RECQLMAPK1CYP2C9 | |
| SCHEMBL4027524 | 0.80 | CYP3A4 (0.53) | CYP3A4CYP1A2RECQLMAPK1CYP2C9 | |
| SCHEMBL2447162 | 0.76 | CYP3A4 (0.50) | CYP3A4CYP1A2RECQLMAPK1CYP2C9 | |
| SCHEMBL4583697 | 0.76 | KMT2A (0.48) | CYP3A4CYP2C9CYP2C19ALDH1A1NPC1 | |
| SCHEMBL5948337 | 0.75 | CYP3A4 (0.67) | CYP3A4CYP1A2RECQLMAPK1CYP2C9 | |
| SCHEMBL17028984 | 0.74 | ALDH1A1 (0.42) | CYP3A4CYP1A2RECQLMAPK1CYP2C9 | |
| SCHEMBL3725498 | 0.74 | KDM4E (0.51) | ALDH1A1SMN1; SMN2NPC1MAPTRAB9A | |
| SCHEMBL4596217 | 0.73 | NPC1 (0.45) | CYP3A4CYP1A2CYP2C9CYP2C19ALDH1A1 |
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 |