Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IP6K1 | Q92551 | 1/20 | 0.46 |
| ▸ | CHEK2 | O96017 | 8/20 | 0.45 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | GRM2 | Q14416 | 3/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 2/20 | 0.38 |
| ▸ | CDC7 | O00311 | 1/20 | 0.38 |
| ▸ | PLK4 | O00444 | 1/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.38 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.38 |
| ▸ | PAK4 | O96013 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31428846 | 1.00 | IP6K1 (0.46) | IP6K1CHEK2DPP4GRM2MKNK1 | |
| SCHEMBL31428714 | 0.82 | IP6K1 (0.48) | IP6K1CHEK2DPP4MKNK1MKNK2 | |
| SCHEMBL24976057 | 0.82 | IP6K1 (0.48) | IP6K1CHEK2DPP4MKNK1MKNK2 | |
| SCHEMBL31428706 | 0.82 | ABCG2 (0.47) | LCKHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL24977054 | 0.82 | ABCG2 (0.47) | LCKHDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL24976120 | 0.79 | MAPT (0.57) | ERN1MEN1ALDH1A1KMT2A | |
| SCHEMBL31428817 | 0.79 | MAPT (0.57) | ERN1MEN1ALDH1A1KMT2A | |
| SCHEMBL31428671 | 0.79 | HPGD (0.50) | GRM2ERN1JAK3JAK2JAK1 | |
| SCHEMBL31428814 | 0.78 | MAPK1 (0.43) | IP6K1CHEK2DPP4JAK3CDC7 | |
| SCHEMBL18152462 | 0.75 | ERN1 (0.51) | IP6K1CHEK2MKNK1MKNK2ERN1 |
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-2023008577-A1 | RAS/RAF BINDING INHIBITOR COMPOUND | 国立大学法人神戸大学 | 2023-02-02 | — | — | WO | disclosed |