Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 4/20 | 0.42 |
| ▸ | AKT2 | P31751 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.39 |
| ▸ | IP6K1 | Q92551 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KIT | P10721 | 2/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL1534437 | 0.89 | AKT1 (0.41) | AKT1AKT2CYP3A4CYP2C8IP6K1 | |
| SCHEMBL14119098 | 0.88 | IP6K1 (0.43) | AKT1AKT2CYP3A4CYP2C8IP6K1 | |
| SCHEMBL1534821 | 0.84 | AKT1 (0.44) | AKT1AKT2CYP3A4CYP2C8KDM4E | |
| SCHEMBL1534619 | 0.83 | PLA2G2A (0.46) | AKT1AKT2CYP3A4KDM4EALDH1A1 | |
| SCHEMBL1901791 | 0.83 | PLA2G2A (0.46) | AKT1AKT2CYP3A4KDM4EALDH1A1 | |
| SCHEMBL1534320 | 0.82 | CYP3A4 (0.42) | AKT1AKT2CYP3A4CYP2C8KDM4E | |
| SCHEMBL1534471 | 0.82 | AKT1 (0.45) | AKT1AKT2CYP3A4CYP2C8KDM4E | |
| SCHEMBL1534384 | 0.81 | AKT1 (0.40) | AKT1AKT2CYP3A4CYP2C8KDM4E | |
| SCHEMBL1534610 | 0.81 | ALDH1A1 (0.48) | AKT1AKT2CYP3A4KDM4EALDH1A1 | |
| SCHEMBL14118761 | 0.81 | IP6K1 (0.41) | AKT1AKT2CYP3A4CYP2C8IP6K1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011055115-A1 | AKT / PKB INHIBITORS | ALMAC DISCOVERY LIMITED (GB) | 2011-05-12 | — | — | WO | disclosed |