Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.59 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.56 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 4/20 | 0.54 |
| ▸ | AR | P10275 | 2/20 | 0.54 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.54 |
| ▸ | SRC | P12931 | 1/20 | 0.53 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.53 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11078325 | 0.92 | ABCG2 (0.59) | NFE2L2ALOX5CYP1A1CYP1A2CYP2D6 | |
| SCHEMBL1764951 | 0.88 | NFE2L2 (0.70) | NFE2L2ALOX5CYP1A1CYP1A2CYP2D6 | |
| SCHEMBL11078318 | 0.86 | NFE2L2 (0.60) | NFE2L2ALOX5CYP1A1CYP1A2CYP2D6 | |
| SCHEMBL4864045 | 0.84 | NFE2L2 (0.72) | NFE2L2ALOX5CYP1A1CYP1A2CYP2D6 | |
| SCHEMBL5084423 | 0.82 | MAOB (0.80) | NFE2L2ALOX5CYP1A1CYP1A2CYP2D6 | |
| SCHEMBL5084427 | 0.82 | MAOB (0.80) | NFE2L2ALOX5CYP1A1CYP1A2CYP2D6 | |
| SCHEMBL7096835 | 0.81 | NFE2L2 (0.63) | NFE2L2ALOX5CYP1A1CYP1A2CYP2D6 | |
| SCHEMBL7097185 | 0.79 | ALDH1A1 (0.68) | NFE2L2ALOX5CYP1A1CYP1A2CYP2D6 | |
| SCHEMBL27794060 | 0.79 | NFE2L2 (0.60) | NFE2L2ALOX5CYP1A1CYP1A2CYP2D6 | |
| SCHEMBL7099531 | 0.79 | PTPN1 (0.61) | NFE2L2ALOX5CYP1A1CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0021000-B1 | SUBSTITUTED ACETOPHENONES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1984-02-22 | — | — | EP | claimed |