Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.55 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.55 |
| ▸ | ABAT | P80404 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.55 |
| ▸ | ERN1 | O75460 | 5/20 | 0.53 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5476629 | 1.00 | EGFR (0.58) | EGFRALDH1A1HPGDTRIM24ALDH5A1 | |
| Syringaldehyde SCHEMBL150376 | 0.88 | ALDH1A1 (0.62) | ALDH1A1HPGDTRIM24ALDH5A1ABAT | |
| Syringaldehyde SCHEMBL30119623 | 0.88 | ALDH1A1 (0.62) | ALDH1A1HPGDTRIM24ALDH5A1ABAT | |
| Syringaldehyde SCHEMBL2110596 | 0.88 | ALDH1A1 (0.62) | ALDH1A1HPGDTRIM24ALDH5A1ABAT | |
| Syringaldehyde SCHEMBL11013780 | 0.86 | ALDH1A1 (0.60) | ALDH1A1HPGDTRIM24ALDH5A1ABAT | |
| Syringaldehyde SCHEMBL28299840 | 0.86 | ALDH1A1 (0.60) | ALDH1A1HPGDTRIM24ALDH5A1ABAT | |
| Syringaldehyde SCHEMBL27352107 | 0.86 | ALDH1A1 (0.60) | ALDH1A1HPGDTRIM24ALDH5A1ABAT | |
| Syringaldehyde SCHEMBL29724072 | 0.86 | ALDH1A1 (0.60) | ALDH1A1HPGDTRIM24ALDH5A1ABAT | |
| Syringaldehyde SCHEMBL28642631 | 0.86 | ALDH1A1 (0.60) | ALDH1A1HPGDTRIM24ALDH5A1ABAT | |
| SCHEMBL28901029 | 0.85 | ERN1 (0.69) | EGFRALDH1A1HPGDTRIM24ALDH5A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |