Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HNF4A | P41235 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | CA12 | O43570 | 2/20 | 0.32 |
| ▸ | CA9 | Q16790 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | RARA | P10276 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11503264 | 0.79 | MAPT (0.41) | HNF4AMAPTNPSR1MAPK1ALDH1A1 | |
| SCHEMBL11217652 | 0.79 | RARA (0.39) | HNF4AMAPTNPSR1MAPK1CYP2D6 | |
| SCHEMBL11210750 | 0.77 | ACHE (0.36) | NPSR1CYP2D6CYP2C19CYP1A2KMT2A | |
| SCHEMBL11214138 | 0.75 | CYP3A4 (0.33) | HNF4ANPSR1MAPK1ALDH1A1CYP2D6 | |
| SCHEMBL11214828 | 0.74 | MAPT (0.42) | HNF4AMAPTNPSR1MAPK1ALDH1A1 | |
| SCHEMBL651789 | 0.70 | MAPT (0.50) | HNF4AMAPTNPSR1MAPK1ALDH1A1 | |
| SCHEMBL11214331 | 0.70 | RXRA (0.49) | NPSR1CYP2D6CYP2C19KMT2ACYP3A4 | |
| SCHEMBL29977890 | 0.69 | MAPT (0.49) | HNF4AMAPTNPSR1MAPK1ALDH1A1 | |
| SCHEMBL13668264 | 0.68 | MAPT (0.39) | HNF4AMAPTMAPK1ALDH1A1KMT2A | |
| SCHEMBL15415386 | 0.66 | TSHR (0.43) | HNF4AMAPTNPSR1MAPK1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4326055-A | ANTITUMOR AGENTS, SKIN DISORDERS, RHEUMATIC DISEASES | HOFFMANN-LA ROCHE INC. (US) | 1982-04-20 | — | — | US | disclosed |
| EP-0002742-B1 | STILBENE DERIVATIVES, THEIR PREPARATION AND MEDICINES CONTAINING THESE STILBENE DERIVATIVES | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1982-04-14 | — | — | EP | disclosed |