Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | RARA | P10276 | 6/20 | 0.32 |
| ▸ | RARB | P10826 | 6/20 | 0.32 |
| ▸ | RARG | P13631 | 6/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
| ▸ | RXRA | P19793 | 5/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.30 |
| ▸ | RXRB | P28702 | 2/20 | 0.30 |
| ▸ | RXRG | P48443 | 2/20 | 0.30 |
| ▸ | RORC | P51449 | 2/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.30 |
| ▸ | HTR2B | P41595 | 2/20 | 0.30 |
| ▸ | BLM | P54132 | 2/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.30 |
| ▸ | NR4A1 | P22736 | 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 | |
|---|---|---|---|---|
| SCHEMBL9840296 | 1.00 | MAPT (0.51) | MAPTALOX15CYP1A2RARARARB | |
| SCHEMBL8776424 | 0.79 | MAPT (0.61) | MAPTALOX15CYP1A2RARARARB | |
| SCHEMBL8390312 | 0.77 | MAPT (0.67) | MAPTALOX15CYP1A2RARARARB | |
| SCHEMBL8390315 | 0.77 | MAPT (0.67) | MAPTALOX15CYP1A2RARARARB | |
| SCHEMBL1472108 | 0.75 | CYP1A2 (0.57) | MAPTALOX15CYP1A2RARARARB | |
| SCHEMBL3307322 | 0.75 | CYP1A2 (0.57) | MAPTALOX15CYP1A2RARARARB | |
| SCHEMBL1472109 | 0.75 | CYP1A2 (0.57) | MAPTALOX15CYP1A2RARARARB | |
| SCHEMBL10938531 | 0.74 | MAPT (0.51) | MAPTALOX15CYP1A2CYP3A4 | |
| SCHEMBL11417197 | 0.74 | MAPT (0.85) | MAPTALOX15CYP1A2RARARARB | |
| SCHEMBL7838956 | 0.74 | MAPT (0.48) | MAPTALOX15CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0260585-B1 | BICYCLIC KETONES, METHOD FOR THEIR PRODUCTION AND AROMA AND/OR FLAVOUR COMPOSITIONS CONTAINING SAID KETONES | L. GIVAUDAN & CIE Société Anonyme (CH) | 1991-10-16 | — | — | EP | disclosed |
| US-4877904-A | Bicyclic ketones as odorants and flavorants | GIVAUDAN CORPORATION (US) | 1989-10-31 | — | — | US | disclosed |
| EP-0260585-A2 | Bicyclic ketones, method for their production and aroma and/or flavour compositions containing said ketones | L. GIVAUDAN & CIE Société Anonyme (CH) | 1988-03-23 | — | — | EP | disclosed |