Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | RXRB | P28702 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 3/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL30984464 | 0.84 | CA1 (0.46) | IDO1MAOBKMT2AALDH1A1MAOA | |
| SCHEMBL30984447 | 0.84 | IDO1 (0.44) | RXRARXRBIDO1MAOBKDM4E | |
| SCHEMBL30984448 | 0.82 | GRM5 (0.43) | IDO1MAOBMAOAMMP1HRH3 | |
| SCHEMBL30984442 | 0.82 | GSK3B (0.44) | RXRARXRBIDO1MAOBKDM4E | |
| SCHEMBL6905812 | 0.81 | TSHR (0.52) | KMT2AMAPTALDH1A1L3MBTL1 | |
| SCHEMBL30984463 | 0.80 | IDO1 (0.49) | IDO1MAOBFFAR1FFAR4MAOA | |
| SCHEMBL1760266 | 0.79 | FFAR1 (0.51) | RXRARXRBIDO1MAOBKDM4E | |
| SCHEMBL11543183 | 0.79 | HTT (0.50) | IDO1FFAR1MAPTALDH1A1 | |
| SCHEMBL3019548 | 0.75 | MEN1 (0.47) | KDM4EKMT2AMAPTHPGDGLA | |
| SCHEMBL11732430 | 0.74 | POLB (0.51) | RXRARXRBKDM4EKMT2AMAPT |
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-117164418-B | Alpha-halogenated ketone, efficient synthesis method and application thereof | 徐州医科大学 | 2024-07-02 | — | — | CN | disclosed |