Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.45 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.45 |
| ▸ | TDO2 | P48775 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.43 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.42 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.42 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.42 |
| ▸ | ERN1 | O75460 | 3/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23123842 | 1.00 | CYP19A1 (0.47) | CYP19A1MAPK1MKNK1MKNK2TDO2 | |
| SCHEMBL23123915 | 0.88 | CYP19A1 (0.43) | CYP19A1MAPK1MKNK1MKNK2TDO2 | |
| SCHEMBL4865238 | 0.84 | CYP19A1 (0.47) | CYP19A1MAPK1MKNK1MKNK2TDO2 | |
| SCHEMBL4866869 | 0.77 | MKNK1 (0.47) | CYP19A1MAPK1MKNK1MKNK2TDO2 | |
| SCHEMBL23411188 | 0.76 | MAPK1 (0.45) | CYP19A1MAPK1MKNK1MKNK2TDO2 | |
| SCHEMBL28797380 | 0.75 | SLC2A1 (0.40) | TDO2MAPTPDGFRBPIK3CBPIK3CG | |
| SCHEMBL23124167 | 0.74 | PDGFRB (0.55) | CYP19A1MAPK1CYP2A6PDGFRB | |
| SCHEMBL31174412 | 0.74 | CYP2A6 (0.68) | CYP19A1MKNK1MKNK2TDO2CYP2A6 | |
| SCHEMBL3754419 | 0.74 | CYP2A6 (0.68) | CYP19A1MKNK1MKNK2TDO2CYP2A6 | |
| SCHEMBL7644646 | 0.74 | PDGFRB (0.49) | MAPK1TDO2MAPTPDGFRB |
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 |
|---|---|---|---|---|---|---|---|
| CN-114787135-A | Substituted imidazole carboxamides and their use in the treatment of medical disorders | 比亚尔R&D投资股份公司 | 2022-07-22 | — | — | CN | disclosed |