Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29167667 | 0.91 | TRPV3 (0.35) | ALDH1A1TDP1KDM4E | |
| SCHEMBL29167684 | 0.86 | NPSR1 (0.36) | TDP1KDM4EKMT2A | |
| SCHEMBL29167626 | 0.85 | TRPA1 (0.33) | ALDH1A1ALOX15HSD17B10KDM4E | |
| SCHEMBL29167645 | 0.85 | PSEN1 (0.32) | — | |
| SCHEMBL29167679 | 0.84 | SLC6A2 (0.33) | — | |
| SCHEMBL29167680 | 0.83 | KMT2A (0.40) | ALDH1A1HPGDKDM4EKMT2A | |
| SCHEMBL29167744 | 0.83 | CNR1 (0.35) | KMT2A | |
| SCHEMBL29167712 | 0.82 | MAPT (0.31) | ALDH1A1HPGDALOX15HSD17B10TDP1 | |
| SCHEMBL29167671 | 0.79 | CASP6 (0.32) | — | |
| SCHEMBL29167659 | 0.77 | L3MBTL1 (0.39) | CYP2D6ALDH1A1HPGDALOX15KDM4E |
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-117624029-A | Arylpyridine or arylpiperidine derivative or salt thereof, synthesis and application and medicine | 赣江中药创新中心 | 2024-03-01 | — | — | CN | disclosed |