Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27795562 | 1.00 | ALDH1A1 (0.47) | ALDH1A1GAAHTTMAPTNPSR1 | |
| SCHEMBL3615057 | 0.88 | ALDH1A1 (0.47) | ALDH1A1GAAHTTMAPTNPSR1 | |
| SCHEMBL31607514 | 0.86 | ALDH1A1 (0.36) | ALDH1A1GAAHTTMAPTLMNA | |
| SCHEMBL30939738 | 0.84 | ALDH1A1 (0.47) | ALDH1A1GAAHTTMAPTNPSR1 | |
| SCHEMBL4479590 | 0.84 | ALDH1A1 (0.47) | ALDH1A1GAAHTTMAPTNPSR1 | |
| SCHEMBL10129547 | 0.83 | GAA (0.48) | ALDH1A1GAAHTTMAPTNPSR1 | |
| SCHEMBL2821496 | 0.82 | LMNA (0.43) | ALDH1A1MAPTLMNARECQLKMT2A | |
| SCHEMBL5705174 | 0.81 | KMT2A (0.43) | ALDH1A1GAAHTTMAPTNPSR1 | |
| SCHEMBL30002654 | 0.80 | MAPT (0.45) | ALDH1A1GAAHTTMAPTNPSR1 | |
| SCHEMBL6562681 | 0.80 | GAA (0.46) | ALDH1A1GAAHTTMAPTNPSR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115232144-B | Nitrogen-containing condensed ring derivative, pharmaceutical composition, and preparation method and application thereof | 长春金赛药业有限责任公司 | 2024-04-02 | — | — | CN | disclosed |
| CN-115232144-A | Nitrogen-containing fused ring derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-10-25 | — | — | CN | disclosed |