Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | HEXA | P06865 | 1/20 | 0.36 |
| ▸ | HEXB | P07686 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23403618 | 0.91 | NR1H3 (0.38) | ESR1MAPTALDH1A1CNR1TP53 | |
| SCHEMBL23401544 | 0.89 | MAPT (0.40) | ESR1MAPTADORA2AADORA2BALDH1A1 | |
| SCHEMBL23398947 | 0.88 | MAPT (0.42) | ESR1MAPTADORA2AADORA2BALDH1A1 | |
| SCHEMBL23399225 | 0.87 | MAPT (0.41) | MAPTADORA2AHEXAHEXBALDH1A1 | |
| SCHEMBL23400102 | 0.86 | MAPT (0.44) | ESR1MAPTADORA2ACNR1KDM4E | |
| SCHEMBL23402410 | 0.85 | HPGD (0.36) | ESR1MAPTADORA2AADORA2BALDH1A1 | |
| SCHEMBL23400505 | 0.84 | ADORA2A (0.41) | ESR1MAPTADORA2AADORA2BALDH1A1 | |
| SCHEMBL23402785 | 0.84 | GRM5 (0.39) | ESR1MAPTHEXAHEXBALDH1A1 | |
| SCHEMBL23400206 | 0.83 | ESR1 (0.48) | ESR1MAPTADORA2AADORA2BALDH1A1 | |
| SCHEMBL23398607 | 0.82 | HEXA (0.34) | MAPTHEXAHEXBALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3828159-A1 | STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS | BASF SE (DE) | 2021-06-02 | — | — | EP | disclosed |