Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.49 |
| ▸ | P4HB | P07237 | 2/20 | 0.47 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 2/20 | 0.47 |
| ▸ | PGR | P06401 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2608968 | 0.90 | MEN1 (0.52) | CYP3A4CYP2D6MAPK1CYP1A2CYP2C9 | |
| SCHEMBL10931500 | 0.88 | MEN1 (0.51) | CYP3A4CYP2D6MAPK1CYP1A2CYP2C9 | |
| SCHEMBL1599758 | 0.87 | CYP3A4 (0.54) | CYP3A4CYP2D6MAPK1CYP1A2CYP2C9 | |
| SCHEMBL18626121 | 0.87 | CYP3A4 (0.54) | CYP3A4CYP2D6MAPK1CYP1A2CYP2C9 | |
| SCHEMBL11423964 | 0.85 | TAAR1 (0.54) | CYP3A4CYP2D6CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL9799615 | 0.85 | CYP3A4 (0.53) | CYP3A4CYP2D6MAPK1CYP1A2CYP2C9 | |
| SCHEMBL7990464 | 0.84 | MAPK9 (0.54) | CYP3A4CYP2D6MAPK1CYP1A2CYP2C9 | |
| SCHEMBL29664492 | 0.83 | KMT2A (0.54) | CYP3A4CYP2D6MAPK1CYP1A2CYP2C9 | |
| SCHEMBL1155200 | 0.83 | KMT2A (0.54) | CYP3A4CYP2D6MAPK1CYP1A2CYP2C9 | |
| SCHEMBL13882955 | 0.82 | CYP3A4 (0.50) | CYP3A4CYP2D6MAPK1CYP1A2CYP2C9 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6194019-B1 | ORGANOLEPTIC 1,2-DIOL DISUBSTITUTED WITH PHENYL, CYCLOHEXYL, OR BENZODIOXOLE RINGS; FOODS, TOBACCO; MASKING SMOKE ODORS | GIVAUDAN S.A. (CH) | 2001-02-27 | — | — | US | claimed |
| EP-0746986-B1 | Delayed release flavourant compositions | GIVAUDAN ROURE INT (CH) | 2000-08-23 | — | — | EP | claimed |
| US-5904148-A | Delayed release flavorant compositions | GIVADUAN-ROURE (INTERNATIONAL) SA (CH) | 1999-05-18 | — | — | US | claimed |
| EP-0746986-A2 | Delayed release flavourant compositions | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1996-12-11 | — | — | EP | claimed |
| US-6194019-B1 | ORGANOLEPTIC 1,2-DIOL DISUBSTITUTED WITH PHENYL, CYCLOHEXYL, OR BENZODIOXOLE RINGS; FOODS, TOBACCO; MASKING SMOKE ODORS | GIVAUDAN S.A. (CH) | 2001-02-27 | — | — | US | disclosed |
| EP-0746986-B1 | Delayed release flavourant compositions | GIVAUDAN ROURE INT (CH) | 2000-08-23 | — | — | EP | disclosed |
| US-5921247-A | Delayed release flavorant compositions | GIVAUDAN-ROURE (INTERNATIONAL) SA (CH) | 1999-07-13 | — | — | US | disclosed |
| US-5904148-A | Delayed release flavorant compositions | GIVADUAN-ROURE (INTERNATIONAL) SA (CH) | 1999-05-18 | — | — | US | disclosed |
| EP-0746986-A2 | Delayed release flavourant compositions | GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) | 1996-12-11 | — | — | EP | disclosed |