Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 14/20 | 0.49 |
| ▸ | PIK3R1 | P27986 | 10/20 | 0.47 |
| ▸ | MTOR | P42345 | 5/20 | 0.47 |
| ▸ | RICTOR | Q6R327 | 2/20 | 0.47 |
| ▸ | RPTOR | Q8N122 | 2/20 | 0.47 |
| ▸ | MAPKAP1 | Q9BPZ7 | 2/20 | 0.47 |
| ▸ | MLST8 | Q9BVC4 | 2/20 | 0.47 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24698993 | 0.85 | KDM4E (0.43) | PIK3CAHRH2HRH3KDM4EALDH1A1 | |
| SCHEMBL29134842 | 0.82 | PIK3CA (0.41) | PIK3CAPIK3R1MTORRICTORRPTOR | |
| SCHEMBL24699439 | 0.82 | PIK3CA (0.41) | PIK3CAPIK3R1MTORRICTORRPTOR | |
| SCHEMBL24698938 | 0.81 | BACE1 (0.41) | PIK3CAMTORHRH2HRH3KDM4E | |
| SCHEMBL24698785 | 0.80 | KDM4E (0.50) | PIK3CAPIK3R1MTORRICTORRPTOR | |
| SCHEMBL24699477 | 0.79 | ALDH1A1 (0.47) | HRH2HRH3KDM4EALDH1A1 | |
| SCHEMBL24697795 | 0.79 | ALDH1A1 (0.40) | PIK3CAHRH2HRH3KDM4EALDH1A1 | |
| SCHEMBL24698171 | 0.78 | ALDH1A1 (0.54) | KDM4EALDH1A1 | |
| SCHEMBL24698106 | 0.78 | HRH2 (0.39) | HRH2HRH3KDM4EALDH1A1 | |
| SCHEMBL24698115 | 0.78 | HRH2 (0.41) | HRH2HRH3KDM4EALDH1A1 |
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-2022212194-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2022-10-06 | — | — | WO | disclosed |