Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC13A5 | Q86YT5 | 3/20 | 0.44 |
| ▸ | SLC13A2 | Q13183 | 1/20 | 0.44 |
| ▸ | SLC13A3 | Q8WWT9 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | FLT3 | P36888 | 2/20 | 0.31 |
| ▸ | CSF1R | P07333 | 1/20 | 0.31 |
| ▸ | KIT | P10721 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | AURKC | Q9UQB9 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | GAA | P10253 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24802460 | 0.81 | PIK3CG (0.32) | PIK3CG | |
| SCHEMBL21408261 | 0.81 | CYP2C9 (0.38) | CYP3A4CYP2C9PIK3CGFLT3CSF1R | |
| SCHEMBL30434407 | 0.81 | CYP2C9 (0.38) | CYP3A4CYP2C9PIK3CGFLT3CSF1R | |
| SCHEMBL12093547 | 0.78 | SLC13A5 (0.51) | SLC13A5SLC13A2SLC13A3CYP3A4CYP2C9 | |
| SCHEMBL24092341 | 0.77 | SLC13A5 (0.47) | SLC13A5SLC13A2SLC13A3CYP3A4CYP2C9 | |
| SCHEMBL20670339 | 0.77 | SLC13A5 (0.47) | SLC13A5SLC13A2SLC13A3CYP3A4CYP2C9 | |
| SCHEMBL5780868 | 0.77 | SLC13A5 (0.50) | SLC13A5SLC13A2SLC13A3CYP3A4CYP2C9 | |
| SCHEMBL5780686 | 0.77 | SLC13A5 (0.50) | SLC13A5SLC13A2SLC13A3CYP3A4CYP2C9 | |
| SCHEMBL22854614 | 0.75 | AR (0.34) | DYRK1AALDH1A1 | |
| SCHEMBL25554902 | 0.75 | PIK3CD (0.33) | KDM4EALDH1A1 |
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-2022268209-A1 | DERIVATIVE HAVING PYRIMIDINE-FUSED CYCLIC STRUCTURE, AND USE THEREOF | 四川汇宇制药股份有限公司 | 2022-12-29 | — | — | WO | disclosed |