Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 6/20 | 0.53 |
| ▸ | MKNK2 | Q9HBH9 | 6/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.46 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | ERN1 | O75460 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28286301 | 0.98 | MKNK1 (0.51) | MKNK1MKNK2CYP2A6CYP1A2CYP3A4 | |
| SCHEMBL18528875 | 0.90 | CYP2A6 (0.52) | MKNK1MKNK2CYP2A6CYP1A2CYP3A4 | |
| SCHEMBL27244471 | 0.88 | CYP2A6 (0.60) | MKNK1MKNK2CYP2A6CYP1A2CYP3A4 | |
| SCHEMBL28286315 | 0.85 | MKNK1 (0.49) | MKNK1MKNK2CYP2A6CYP1A2CYP3A4 | |
| SCHEMBL28592192 | 0.84 | MKNK1 (0.58) | MKNK1MKNK2CYP2A6CYP1A2CYP3A4 | |
| SCHEMBL28606690 | 0.83 | MKNK1 (0.56) | MKNK1MKNK2CYP2A6CYP1A2CYP3A4 | |
| SCHEMBL28919156 | 0.83 | MKNK1 (0.56) | MKNK1MKNK2CYP2A6CYP1A2CYP3A4 | |
| SCHEMBL28598273 | 0.83 | MKNK1 (0.56) | MKNK1MKNK2CYP2A6CYP1A2CYP3A4 | |
| SCHEMBL31663556 | 0.80 | CYP2A6 (0.54) | MKNK1MKNK2CYP2A6CYP1A2CYP3A4 | |
| SCHEMBL28674858 | 0.78 | CYP2A6 (0.61) | MKNK1MKNK2CYP2A6CYP1A2CYP3A4 |
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-109689665-A | Metal complex and electron transport material using the same | 大电株式会社 | 2019-04-26 | — | — | CN | disclosed |