Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.32 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MPL | P40238 | 4/20 | 0.31 |
| ▸ | FFAR4 | Q5NUL3 | 5/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.30 |
| ▸ | RARA | P10276 | 1/20 | 0.30 |
| ▸ | RARG | P13631 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9630243 | 0.99 | RARB (0.33) | RARBCYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL9631056 | 0.96 | RARB (0.39) | RARBS1PR3ITGB3ITGA2BFAAH | |
| SCHEMBL9630345 | 0.96 | RARB (0.39) | RARBS1PR3ITGB3ITGA2BFAAH | |
| SCHEMBL9630364 | 0.96 | RARB (0.39) | RARBS1PR3ITGB3ITGA2BFAAH | |
| SCHEMBL9632544 | 0.96 | RARB (0.39) | RARBS1PR3ITGB3ITGA2BFAAH | |
| SCHEMBL9631468 | 0.96 | RARB (0.32) | RARBMPLFFAR4MAOAMAOB | |
| SCHEMBL9631304 | 0.95 | RARB (0.38) | RARBITGB3ITGA2BMPLFAAH | |
| SCHEMBL9630538 | 0.93 | CYP3A4 (0.31) | RARBCYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL9631133 | 0.93 | CYP3A4 (0.31) | RARBCYP3A4CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL9630433 | 0.93 | RARB (0.38) | RARBITGB3ITGA2BMPLFAAH |
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-0364538-B1 | DIFLUOROBENZOL DERIVATIVES | MERCK PATENT GmbH (DE) | 1992-05-06 | — | — | EP | disclosed |