Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.49 |
| ▸ | ALDH1A3 | P47895 | 6/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.45 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL28089000 | 0.76 | MCL1 (0.47) | ALDH1A1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL28833063 | 0.74 | CYP2A6 (0.56) | ALDH1A1CYP2A6KDM4EMAPTMEN1 | |
| SCHEMBL8791762 | 0.74 | KMT2A (0.46) | ALDH1A1KDM4EMAPTMEN1KMT2A | |
| SCHEMBL28812822 | 0.72 | CYP2A6 (0.54) | ALDH1A1ALDH1A3CYP2A6KDM4EMAPT | |
| SCHEMBL28088869 | 0.70 | CYP2A6 (0.51) | ALDH1A1ALDH1A3CYP2A6SMN1; SMN2KDM4E | |
| SCHEMBL24988105 | 0.69 | TRIM24 (0.67) | ALDH1A1ALDH1A3SMN1; SMN2TRIM24TRIM33 | |
| SCHEMBL30343620 | 0.69 | TRIM24 (0.67) | ALDH1A1ALDH1A3SMN1; SMN2TRIM24TRIM33 | |
| SCHEMBL31300670 | 0.69 | HSD17B10 (0.62) | ALDH1A1CYP2A6SMN1; SMN2KDM4EMEN1 | |
| SCHEMBL12278059 | 0.69 | MEN1 (0.39) | ALDH1A1MAPTMEN1KMT2AGSK3B | |
| SCHEMBL12278882 | 0.69 | MEN1 (0.39) | ALDH1A1MEN1KMT2AGSK3B |
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-105859639-A | NOVEL ANTI-INFLAMMATORY AGENTS | 雷斯韦洛吉克斯公司 | 2016-08-17 | — | — | CN | disclosed |