Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 12/20 | 0.33 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.33 |
| ▸ | SCN7A | Q01118 | 7/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.32 |
| ▸ | BRAF | P15056 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25910429 | 0.89 | KDM4E (0.38) | KDM4EALDH1A1POLBHPGDMAPK10 | |
| SCHEMBL25910411 | 0.84 | PDGFRB (0.45) | BRAF | |
| SCHEMBL25913399 | 0.77 | CSF1R (0.39) | ALDH1A1SCN9ABRAF | |
| SCHEMBL25911790 | 0.75 | CSF1R (0.53) | SCN9ABRAF | |
| SCHEMBL25914740 | 0.75 | CSF1R (0.35) | ALDH1A1SCN9ABRAF | |
| SCHEMBL25910295 | 0.74 | SCN9A (0.34) | PDE3BPDE3ASCN9ASCN10A | |
| SCHEMBL25913446 | 0.72 | MAOA (0.35) | ALDH1A1SCN7AKCNH2BRAF | |
| SCHEMBL25911492 | 0.71 | TLR7 (0.34) | SCN9ASCN10AKCNH2 | |
| SCHEMBL25914665 | 0.71 | CSF1R (0.39) | SCN9ABRAF | |
| SCHEMBL30673544 | 0.69 | CSF1R (0.67) | — |
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-2023125812-A1 | SUBSTITUTED PYRIMIDONE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF | 上海海雁医药科技有限公司 | 2023-07-06 | — | — | WO | disclosed |