Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSIP1 | O75475 | 1/20 | 0.52 |
| ▸ | HSD11B1 | P28845 | 7/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP3 | P08254 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP14 | P50281 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7924711 | 0.85 | MMP2 (0.63) | ALDH1A1HTTPOLBMMP1MMP13 | |
| SCHEMBL2448610 | 0.84 | PSIP1 (0.56) | PSIP1HSD11B1ALDH1A1TP53HTT | |
| SCHEMBL8474920 | 0.83 | ALDH1A1 (0.60) | ALDH1A1MAPTMMP1MMP13KMT2A | |
| SCHEMBL27279139 | 0.81 | HSD11B1 (0.50) | PSIP1HSD11B1ALDH1A1TP53HTT | |
| SCHEMBL7000851 | 0.81 | PSIP1 (0.48) | PSIP1HSD11B1ALDH1A1TP53HTT | |
| SCHEMBL28973785 | 0.81 | PSIP1 (0.52) | PSIP1HSD11B1ALDH1A1TP53HTT | |
| SCHEMBL20996662 | 0.81 | MMP13 (0.65) | PSIP1HSD11B1ALDH1A1TP53HTT | |
| SCHEMBL28973817 | 0.81 | PSIP1 (0.52) | PSIP1HSD11B1ALDH1A1TP53HTT | |
| SCHEMBL20087726 | 0.80 | HSD11B1 (0.49) | PSIP1HSD11B1ALDH1A1TP53HTT | |
| SCHEMBL7724605 | 0.80 | PSIP1 (0.56) | PSIP1HSD11B1ALDH1A1TP53HTT |
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-114716296-B | Efficient halogenation synthesis method of alkyl halide | 润药仁智(北京)科技有限公司 | 2023-12-12 | — | — | CN | disclosed |
| CN-116606232-A | Novel monofluoroalkyl compounds, preparation method and application thereof | 许昌学院 | 2023-08-18 | — | — | CN | disclosed |
| CN-114716296-A | Efficient halogenation synthesis method of alkyl halide | 北京大学 | 2022-07-08 | — | — | CN | disclosed |
| CN-114634432-A | High-efficiency synthesis method of alkyl aryl thioether compound | 北京大学 | 2022-06-17 | — | — | CN | disclosed |