Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 2/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | GRM8 | O00222 | 1/20 | 0.44 |
| ▸ | GRM6 | O15303 | 1/20 | 0.44 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.44 |
| ▸ | LDHA | P00338 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1231373 | 0.83 | LMNA (0.45) | CYP2D6CYP2C19CNR2CNR1ALDH1A1 | |
| SCHEMBL7044792 | 0.82 | AOC3 (0.63) | CYP1A2CYP2C19AOC3CNR2CNR1 | |
| SCHEMBL1230545 | 0.82 | AOC3 (0.54) | AOC3MTNR1AMTNR1BL3MBTL1 | |
| SCHEMBL14870381 | 0.81 | CYP1A2 (0.45) | CYP1A2CYP2D6CYP2C19AOC3MTNR1A | |
| SCHEMBL1230531 | 0.80 | ACHE (0.55) | CYP2C19ALDH1A1CA1CA2LDHA | |
| SCHEMBL20491172 | 0.80 | EPHX2 (0.44) | ALDH1A1KMT2A | |
| SCHEMBL1206387 | 0.79 | GBA1 (0.51) | CYP1A2CYP2D6CYP2C19AOC3MTNR1A | |
| SCHEMBL14861146 | 0.79 | GBA1 (0.51) | CYP1A2CYP2D6CYP2C19AOC3MTNR1A | |
| SCHEMBL14861144 | 0.79 | GBA1 (0.51) | CYP1A2CYP2D6CYP2C19AOC3MTNR1A | |
| SCHEMBL4065435 | 0.78 | HDAC3 (0.42) | CNR2ALDH1A1MAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013056015-A1 | ISOINDOLINONE AND PYRROLOPYRIDINONE DERIVATIVES AS AKT INHIBITORS | INCYTE CORPORATION (US) | 2013-04-18 | — | — | WO | disclosed |
| 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 |