Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TUBB1 | Q9H4B7 | 3/20 | 0.44 |
| ▸ | SRC | P12931 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | INPPL1 | O15357 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | INPP5A | Q14642 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11075262 | 0.77 | KMT2A (0.47) | TUBB1NPC1ALDH1A1TNFRSF1AMAPT | |
| SCHEMBL4864056 | 0.77 | TUBB1 (0.49) | TUBB1POLBNPC1ABCG2ALDH1A1 | |
| SCHEMBL11078844 | 0.77 | TUBB1 (0.40) | TUBB1POLBNPC1ABCG2ALDH1A1 | |
| SCHEMBL1764953 | 0.75 | NPC1 (0.49) | TUBB1POLBNPC1ALDH1A1KDM4E | |
| SCHEMBL8146118 | 0.72 | TUBB1 (0.52) | TUBB1POLBNPC1ABCG2ALDH1A1 | |
| SCHEMBL4535104 | 0.71 | NPC1 (0.54) | POLBNPC1ABCG2ALDH1A1HPGD | |
| SCHEMBL28854515 | 0.70 | MAPT (0.61) | TUBB1ABCG2HSD17B10MAPT | |
| SCHEMBL728021 | 0.70 | ABCG2 (0.51) | POLBABCG2ALDH1A1KDM4EHPGD | |
| SCHEMBL6129273 | 0.70 | ABCG2 (0.51) | POLBABCG2ALDH1A1KDM4EHPGD | |
| SCHEMBL3084514 | 0.69 | INPPL1 (0.65) | SRCABCG2ALDH1A1KDM4EUSP2 |
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 |