Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | SOD1 | P00441 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | NQO1 | P15559 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | RXRB | P28702 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5619009 | 1.00 | CYP3A4 (0.55) | CYP3A4TP53SOD1L3MBTL1LMNA | |
| Alcohol SCHEMBL28543970 | 0.94 | L3MBTL1 (0.51) | CYP3A4TP53SOD1L3MBTL1LMNA | |
| SCHEMBL28543971 | 0.88 | CYP3A4 (0.49) | CYP3A4TP53SOD1L3MBTL1LMNA | |
| SCHEMBL10211503 | 0.85 | L3MBTL1 (0.57) | CYP3A4SOD1L3MBTL1LMNAPOLB | |
| SCHEMBL13191971 | 0.85 | TP53 (0.52) | CYP3A4TP53SOD1L3MBTL1LMNA | |
| SCHEMBL1546661 | 0.85 | TP53 (0.52) | CYP3A4TP53SOD1L3MBTL1LMNA | |
| SCHEMBL12251342 | 0.83 | L3MBTL1 (0.60) | SOD1L3MBTL1LMNAPOLBHTT | |
| SCHEMBL1547082 | 0.83 | TP53 (0.50) | CYP3A4TP53SOD1L3MBTL1LMNA | |
| SCHEMBL13639099 | 0.83 | L3MBTL1 (0.56) | SOD1L3MBTL1LMNAPOLBHTT | |
| SCHEMBL25005890 | 0.82 | SOD1 (0.53) | CYP3A4SOD1L3MBTL1LMNAPOLB |
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-112624993-B | Oxazoline derivative with nitrogen heterocyclic ring structure, preparation thereof and application thereof in preventing and controlling phytophagous mites | 南开大学 | 2022-11-11 | — | — | CN | disclosed |