Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | CES1 | P23141 | 4/20 | 0.52 |
| ▸ | CES2 | O00748 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.46 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29035942 | 0.86 | CA2 (0.64) | CA2ALDH1A1CES1CES2LMNA | |
| SCHEMBL1047383 | 0.84 | CA2 (0.67) | CA2ALDH1A1CES1CES2LMNA | |
| SCHEMBL15851476 | 0.82 | CA2 (0.64) | CA2ALDH1A1CES1CES2LMNA | |
| SCHEMBL16439956 | 0.80 | CA2 (0.68) | CA2ALDH1A1CES1CES2LMNA | |
| SCHEMBL28353006 | 0.80 | CA2 (0.62) | CA2ALDH1A1CES1CES2LMNA | |
| SCHEMBL727083 | 0.79 | CA2 (0.55) | CA2ALDH1A1CES1CES2LMNA | |
| SCHEMBL29137293 | 0.79 | CES1 (0.54) | CA2CES1CES2LMNAGSK3B | |
| SCHEMBL454667 | 0.78 | CA2 (0.71) | CA2ALDH1A1CES1CES2LMNA | |
| SCHEMBL17943237 | 0.78 | CA2 (0.60) | CA2ALDH1A1CES1CES2LMNA | |
| SCHEMBL9770781 | 0.78 | CA2 (0.55) | CA2ALDH1A1CES1CES2LMNA |
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-117326923-A | Fluorine-containing dihydronaphthalenone derivative and preparation method and application thereof | 上海应用技术大学 | 2024-01-02 | — | — | CN | disclosed |