Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ATP4A | P20648 | 7/20 | 0.38 |
| ▸ | ATP4B | P51164 | 7/20 | 0.38 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL5400033 | 0.76 | GSK3B (0.52) | SMN1; SMN2 | |
| SCHEMBL7454799 | 0.76 | MAPT (0.46) | CYP2D6CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL10973799 | 0.74 | GSK3B (0.51) | CYP2D6CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL5400026 | 0.71 | GCGR (0.42) | CYP2D6CYP3A4GCGR | |
| SCHEMBL7450220 | 0.71 | GABRA1 (0.43) | CYP2D6CYP3A4CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL12073354 | 0.68 | AURKA (0.53) | MAPTKDM4EL3MBTL1MEN1KMT2A | |
| SCHEMBL28194680 | 0.68 | ALDH1A1 (0.47) | CYP3A4NPC1MAPTKDM4EALDH1A1 | |
| SCHEMBL27361074 | 0.68 | ALDH1A1 (0.47) | CYP3A4NPC1MAPTKDM4EALDH1A1 | |
| SCHEMBL10918699 | 0.66 | DYRK1A (0.53) | CYP2D6CYP3A4CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL7470679 | 0.66 | HIF1A (0.41) | CYP2D6CYP3A4CYP2C9CYP2C19CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1115721-A1 | PYRIMIDONE DERIVATIVES | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-07-18 | — | — | EP | disclosed |
| WO-2000018758-A1 | PYRIMIDONE DERIVATIVES | MITSUBISHI CHEMICAL CORPORATION (JP) | 2000-04-06 | — | — | WO | disclosed |