Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.68 |
| ▸ | HTT | P42858 | 4/20 | 0.68 |
| ▸ | HPGD | P15428 | 1/20 | 0.68 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | G6PD | P11413 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALPG | P10696 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10824828 | 0.79 | HTT (0.65) | ALDH1A1HTTHPGDL3MBTL1MEN1 | |
| SCHEMBL28825321 | 0.77 | HTT (0.67) | ALDH1A1HTTHPGDL3MBTL1MEN1 | |
| SCHEMBL10910759 | 0.74 | HTT (0.77) | ALDH1A1HTTHPGDL3MBTL1MEN1 | |
| SCHEMBL752826 | 0.72 | HTT (0.66) | ALDH1A1HTTHPGDL3MBTL1MEN1 | |
| SCHEMBL29119917 | 0.72 | CYP3A4 (0.58) | ALDH1A1HTTL3MBTL1MEN1KMT2A | |
| SCHEMBL28825258 | 0.71 | HTT (0.55) | ALDH1A1HTTHPGDL3MBTL1MEN1 | |
| SCHEMBL9047865 | 0.70 | MEN1 (0.62) | HPGDMEN1KMT2ACYP3A4MAPT | |
| SCHEMBL8429903 | 0.69 | ALOX15 (0.46) | HPGDMEN1KMT2APOLBCYP3A4 | |
| SCHEMBL364672 | 0.69 | ESR1 (0.53) | ALDH1A1HTTHPGDMEN1KMT2A | |
| SCHEMBL1616373 | 0.68 | HIF1A (0.54) | HTTHPGDMEN1KMT2ACYP3A4 |
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-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 |