Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MME | P08473 | 1/20 | 0.36 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
| ▸ | CTSA | P10619 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4596289 | 0.83 | ADRB2 (0.51) | KMT2AHIF1AMMEACECTSA | |
| SCHEMBL4596291 | 0.81 | RIPK1 (0.45) | LMNASMN1; SMN2MMEACE | |
| SCHEMBL4595044 | 0.81 | RIPK1 (0.45) | LMNASMN1; SMN2MMEACE | |
| SCHEMBL4389472 | 0.81 | RIPK1 (0.45) | LMNASMN1; SMN2MMEACE | |
| SCHEMBL4595555 | 0.80 | POLB (0.39) | GAASMN1; SMN2CTSA | |
| SCHEMBL15269542 | 0.73 | ROCK2 (0.47) | CNR2GAAALDH1A1CES2CES1 | |
| SCHEMBL2532623 | 0.72 | TDP1 (0.44) | GAAALDH1A1LMNASMN1; SMN2MEN1 | |
| SCHEMBL1529699 | 0.72 | NPC1 (0.45) | MEN1KMT2AMMEACE | |
| SCHEMBL4595990 | 0.71 | AOC3 (0.43) | CNR2ALDH1A1CNR1LMNAMEN1 | |
| SCHEMBL4584586 | 0.71 | GAA (0.46) | CNR2GAAALDH1A1CES2CES1 |
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-1874768-A2 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006113837-A2 | INHIBITORS OF AKT ACTIVITY | SMITHKLINE BEECHAM CORPORATION (US) | 2006-10-26 | — | — | WO | disclosed |