Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PDCD1LG2 | Q9BQ51 | 1/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | BRAF | P15056 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | NCF1 | P14598 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | IRAK4 | Q9NWZ3 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25912751 | 0.82 | MAPK8 (0.39) | BRAFIRAK4 | |
| SCHEMBL25913001 | 0.82 | BRAF (0.35) | HDAC8HDAC6BRAFIRAK4 | |
| SCHEMBL30467033 | 0.82 | BRAF (0.35) | HDAC8HDAC6BRAFIRAK4 | |
| SCHEMBL25914740 | 0.77 | CSF1R (0.35) | MAPTSCN9ABRAFMEN1KMT2A | |
| SCHEMBL25913399 | 0.73 | CSF1R (0.39) | SCN9ABRAFMEN1KMT2AALDH1A1 | |
| SCHEMBL25913446 | 0.69 | MAOA (0.35) | HDAC8HDAC6BRAFMEN1KMT2A | |
| SCHEMBL25911790 | 0.69 | CSF1R (0.53) | SCN9ABRAF | |
| SCHEMBL25914529 | 0.69 | GAA (0.41) | MAPTHDAC8HDAC6RAB9AMEN1 | |
| SCHEMBL25914665 | 0.67 | CSF1R (0.39) | MAPTSCN9ABRAFCYP3A4 | |
| SCHEMBL25913040 | 0.67 | KDM4E (0.38) | SCN9ABRAFALDH1A1HPGD |
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 |