Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 2/20 | 0.47 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.47 |
| ▸ | NQO1 | P15559 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | ACACB | O00763 | 1/20 | 0.42 |
| ▸ | ACACA | Q13085 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 6/20 | 0.42 |
| ▸ | NPC1 | O15118 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9563724 | 0.93 | CYP2D6 (0.53) | FFAR1FFAR4NQO1CYP2D6CYP3A4 | |
| SCHEMBL9563899 | 0.92 | TDP1 (0.43) | FFAR1FFAR4NQO1CYP2D6CYP3A4 | |
| SCHEMBL9494314 | 0.92 | TDP1 (0.43) | FFAR1FFAR4NQO1CYP2D6CYP3A4 | |
| SCHEMBL9563759 | 0.91 | NQO1 (0.56) | FFAR1FFAR4NQO1TDP1ALDH1A1 | |
| SCHEMBL9563824 | 0.90 | CYP2D6 (0.50) | FFAR1FFAR4NQO1CYP2D6CYP3A4 | |
| SCHEMBL11917084 | 0.89 | CYP1A2 (0.46) | FFAR1FFAR4NQO1CYP2D6CYP3A4 | |
| SCHEMBL9563787 | 0.89 | RARB (0.52) | FFAR1FFAR4CYP2D6CYP3A4CYP1A2 | |
| SCHEMBL9563748 | 0.89 | RARB (0.52) | FFAR1FFAR4CYP2D6CYP3A4CYP1A2 | |
| SCHEMBL9563701 | 0.89 | RARB (0.52) | FFAR1FFAR4CYP2D6CYP3A4CYP1A2 | |
| SCHEMBL9563826 | 0.89 | RARB (0.52) | FFAR1FFAR4CYP2D6CYP3A4CYP1A2 |
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-5273680-A | A chiral tilted smectic liquid crystal based on terphenyls | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-12-28 | — | — | US | disclosed |