Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | HPGD | P15428 | 3/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | MMP1 | P03956 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL27914683 | 0.89 | ALDH1A1 (0.55) | ALDH1A1KDM4EHPGDTDP1CYP2C9 | |
| SCHEMBL7627224 | 0.83 | ALDH1A1 (0.72) | ALDH1A1KDM4EHPGDTDP1CYP2C9 | |
| SCHEMBL11697966 | 0.79 | BCAT1 (0.50) | ALDH1A1KDM4EHPGDTDP1CYP2C9 | |
| SCHEMBL17764 | 0.79 | GAA (0.59) | ALDH1A1KDM4EHPGDTDP1CYP2C9 | |
| SCHEMBL29658990 | 0.79 | ALDH1A1 (0.67) | ALDH1A1KDM4EHPGDTDP1CYP2C9 | |
| SCHEMBL29614846 | 0.79 | ALDH1A1 (0.67) | ALDH1A1KDM4EHPGDTDP1CYP2C9 | |
| SCHEMBL418582 | 0.77 | GAA (0.68) | ALDH1A1KDM4EHPGDTDP1CYP2C9 | |
| SCHEMBL16509308 | 0.76 | GAA (0.67) | ALDH1A1KDM4EHPGDTDP1CYP2C9 | |
| SCHEMBL4021554 | 0.75 | ALDH1A1 (0.72) | ALDH1A1KDM4EHPGDTDP1CYP2C9 | |
| SCHEMBL28123632 | 0.75 | CA1 (0.63) | ALDH1A1KDM4EHPGDTDP1CYP2C9 |
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-114409713-A | N-unsubstituted ferrocenopyridone derivative and synthesis method thereof | 山东师范大学 | 2022-04-29 | — | — | CN | claimed |
| CN-113896663-A | Heat-sensitive acid generator and preparation method and application thereof | 北京印刷学院 | 2022-01-07 | — | — | CN | disclosed |