Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 13/20 | 0.36 |
| ▸ | RXRB | P28702 | 10/20 | 0.36 |
| ▸ | RXRG | P48443 | 9/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | RARB | P10826 | 3/20 | 0.35 |
| ▸ | RARG | P13631 | 3/20 | 0.35 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.34 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.34 |
| ▸ | RARA | P10276 | 2/20 | 0.33 |
| ▸ | HNF4A | P41235 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10760162 | 0.93 | MEN1 (0.36) | MEN1LMNAMAPTTHRBHTT | |
| SCHEMBL1615553 | 0.82 | RXRA (0.46) | MEN1KMT2ARXRARXRBRXRG | |
| SCHEMBL29606831 | 0.82 | RXRA (0.46) | MEN1KMT2ARXRARXRBRXRG | |
| SCHEMBL9362670 | 0.79 | RXRA (0.37) | MEN1LMNAMAPTTHRBHTT | |
| SCHEMBL8460990 | 0.76 | LMNA (0.37) | MEN1LMNAMAPTTHRBHTT | |
| SCHEMBL10888162 | 0.72 | RXRA (0.41) | RXRARXRBRXRGRARBRARG | |
| SCHEMBL21259450 | 0.70 | TP53 (0.31) | TP53CYP1A2 | |
| SCHEMBL3179509 | 0.70 | CYP3A4 (0.37) | MEN1LMNAMAPTTHRBHTT | |
| SCHEMBL30695369 | 0.67 | CYP3A4 (0.41) | MEN1LMNAMAPTTHRBHTT | |
| SCHEMBL9770689 | 0.67 | CYP3A4 (0.41) | MEN1LMNAMAPTTHRBHTT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4634548-A | PERFUMES, FLAVORS | GIVAUDAN CORPORATION (US) | 1987-01-06 | — | — | US | disclosed |
| EP-0115274-B1 | EPOXIDES OF BICYCLIC COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PERFUMED AND/OR FLAVOURED COMPOSITIONS CONTAINING THEM | L. GIVAUDAN & CIE Société Anonyme (CH) | 1986-11-05 | — | — | EP | disclosed |
| US-4617146-A | TOBACCO; FOODS; BEVERAGES; PERFUMES | GIVAUDAN CORPORATION (US) | 1986-10-14 | — | — | US | disclosed |
| EP-0116277-A2 | Ketones of bicyclic compounds, process for their preparation, odorant and/or flavouring compositions containing such compounds | L. GIVAUDAN & CIE Société Anonyme (CH) | 1984-08-22 | — | — | EP | disclosed |
| EP-0115274-A1 | Epoxides of bicyclic compounds, process for their preparation and perfumed and/or flavoured compositions containing them | L. GIVAUDAN & CIE Société Anonyme (CH) | 1984-08-08 | — | — | EP | disclosed |