Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | AKT1 | P31749 | 2/20 | 0.35 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27221202 | 1.00 | MEN1 (0.39) | MEN1KMT2ACYP2C19CYP3A4CYP2C9 | |
| SCHEMBL7448737 | 0.78 | ALDH1A1 (0.49) | MEN1KMT2ASMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL7448743 | 0.78 | ALDH1A1 (0.49) | MEN1KMT2ASMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL5170500 | 0.73 | ALDH1A1 (0.41) | MEN1KMT2ASMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL9437359 | 0.71 | KMT2A (0.47) | MEN1KMT2ACYP2C19CYP3A4CYP2C9 | |
| SCHEMBL504005 | 0.71 | L3MBTL1 (0.55) | MEN1KMT2ACYP2C19CYP3A4CYP2C9 | |
| SCHEMBL8736767 | 0.71 | MEN1 (0.43) | MEN1KMT2ACYP2C19CYP3A4CYP2C9 | |
| SCHEMBL27663394 | 0.69 | KCNN4 (0.46) | MEN1KMT2ACYP2C19ALDH1A1TSHR | |
| SCHEMBL7200107 | 0.69 | RAB9A (0.57) | MEN1KMT2ASMN1; SMN2ALDH1A1NPSR1 | |
| SCHEMBL7363893 | 0.69 | KDM4E (0.45) | MEN1KMT2ACYP2C19CYP3A4CYP2C9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112156083-B | Aggregation-induced emission nanoparticle and preparation method and application thereof | 中国科学院深圳先进技术研究院 | 2023-09-05 | — | — | CN | claimed |
| EP-2203420-A1 | HIV PROTEASE INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2010-07-07 | — | — | EP | disclosed |
| WO-2009042093-A1 | HIV PROTEASE INHIBITORS | MERCK & CO., INC. (US) | 2009-04-02 | — | — | WO | disclosed |
| WO-2009042094-A2 | HIV PROTEASE INHIBITORS | MERCK & CO., INC. (US) | 2009-04-02 | — | — | WO | disclosed |