Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.58 |
| ▸ | ALDH1A3 | P47895 | 4/20 | 0.58 |
| ▸ | ALDH3A1 | P30838 | 4/20 | 0.58 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.43 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 5/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | LMNA | P02545 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27831339 | 0.97 | ALDH1A1 (0.61) | ALDH1A1ALDH1A3ALDH3A1CYP2A6CYP2A13 | |
| SCHEMBL31243553 | 0.82 | ALDH1A1 (0.50) | ALDH1A1ALDH1A3ALDH3A1CYP2A6CYP2A13 | |
| SCHEMBL15483881 | 0.80 | CYP2C19 (0.39) | ALDH1A1KDM4EMAPTRECQLMAPK1 | |
| SCHEMBL15239129 | 0.78 | TDP1 (0.52) | ALDH1A1KDM4EMAPTRECQLMAPK1 | |
| SCHEMBL1607796 | 0.77 | ALDH3A1 (0.73) | ALDH1A1ALDH1A3ALDH3A1CYP2A6CYP2A13 | |
| SCHEMBL15483675 | 0.75 | MAPT (0.39) | ALDH1A1GAAMAPTMAPK1GFER | |
| SCHEMBL15483614 | 0.75 | KCNH2 (0.33) | ALDH1A1MEN1KMT2ALMNAMAPT | |
| SCHEMBL15239050 | 0.75 | MAPT (0.48) | ALDH1A1MEN1KMT2ALMNAMAPT | |
| SCHEMBL10942535 | 0.75 | ALDH1A1 (0.83) | ALDH1A1ALDH1A3ALDH3A1CYP2A6CYP2A13 | |
| SCHEMBL5733313 | 0.74 | ALDH1A1 (1.00) | ALDH1A1ALDH1A3ALDH3A1CYP2A6CYP2A13 |
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-118405998-A | Fluorescent probe for detecting Cu (I), preparation method thereof, fluorescent sensor comprising fluorescent probe and used for simultaneously detecting Cu (I) and Cu (II), and preparation method and application thereof | 中国科学院理化技术研究所 | 2024-07-30 | — | — | CN | claimed |
| CN-118405998-A | Fluorescent probe for detecting Cu (I), preparation method thereof, fluorescent sensor comprising fluorescent probe and used for simultaneously detecting Cu (I) and Cu (II), and preparation method and application thereof | 中国科学院理化技术研究所 | 2024-07-30 | — | — | CN | disclosed |