Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.50 |
| ▸ | ABAT | P80404 | 1/20 | 0.50 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.46 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.44 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | TYR | P14679 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.39 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23637785 | 0.92 | ALDH1A1 (0.64) | ALDH1A1ALDH5A1ABATTRIM24TRIM33 | |
| SCHEMBL15906941 | 0.91 | ALDH1A1 (0.54) | ALDH1A1ALDH5A1ABATTRIM24TRIM33 | |
| SCHEMBL29244592 | 0.89 | ALDH1A1 (0.52) | ALDH1A1ALDH5A1ABATTRIM24TRIM33 | |
| SCHEMBL29244371 | 0.89 | ALDH1A1 (0.52) | ALDH1A1ALDH5A1ABATTRIM24TRIM33 | |
| SCHEMBL28326100 | 0.84 | ALDH5A1 (0.57) | ALDH1A1ALDH5A1ABATTRIM24TRIM33 | |
| SCHEMBL976904 | 0.84 | CYP2A6 (0.58) | ALDH1A1ALDH5A1ABATTRIM24TRIM33 | |
| SCHEMBL1666706 | 0.84 | CYP2A6 (0.58) | ALDH1A1ALDH5A1ABATTRIM24TRIM33 | |
| SCHEMBL27335985 | 0.84 | CYP2A6 (0.58) | ALDH1A1ALDH5A1ABATTRIM24TRIM33 | |
| SCHEMBL25288128 | 0.84 | CYP2A6 (0.58) | ALDH1A1ALDH5A1ABATTRIM24TRIM33 | |
| SCHEMBL15901558 | 0.83 | ALDH1A1 (0.60) | ALDH1A1ALDH5A1ABATTRIM24TRIM33 |
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-116539764-A | Analysis method of aromatic organic phosphate in water sample | 青岛理工大学 | 2023-08-04 | — | — | CN | disclosed |