Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30402078 | 0.79 | MEN1 (0.38) | NPC1RAB9ANPSR1POLBALDH1A1 | |
| SCHEMBL28883523 | 0.74 | ALDH1A1 (0.40) | ALDH1A1HPGDALOX15HSD17B10KDM4E | |
| SCHEMBL29007666 | 0.74 | ALDH1A1 (0.43) | RAB9ANPSR1RXFP1ALDH1A1HPGD | |
| SCHEMBL30567363 | 0.73 | ALDH1A1 (0.44) | HTTNPSR1RXFP1ALDH1A1HPGD | |
| SCHEMBL7355299 | 0.70 | ALDH1A1 (0.48) | ALDH1A1HPGDALOX15HSD17B10KDM4E | |
| SCHEMBL11282833 | 0.67 | ALDH1A1 (0.46) | HTTNPC1RAB9AALDH1A1HPGD | |
| SCHEMBL1474781 | 0.65 | HTT (0.55) | HTTNPC1RAB9ANPSR1RXFP1 | |
| SCHEMBL27333189 | 0.63 | L3MBTL1 (0.50) | PKMALDH1A1HPGDALOX15MEN1 | |
| SCHEMBL38658780 | 0.62 | ALDH1A1 (0.57) | ALDH1A1HPGDALOX15HSD17B10MEN1 | |
| SCHEMBL28065953 | 0.62 | ALDH1A1 (0.57) | ALDH1A1HPGDALOX15HSD17B10MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116178486-A | Asymmetric hydrogenation synthesis method and application of non-natural polypeptide | 西南大学 | 2023-05-30 | — | — | CN | claimed |
| CN-115340468-B | (R) -deuterated phenylalanine derivative and preparation method thereof | 西南大学 | 2023-10-24 | — | — | CN | disclosed |
| CN-116178486-A | Asymmetric hydrogenation synthesis method and application of non-natural polypeptide | 西南大学 | 2023-05-30 | — | — | CN | disclosed |