Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | RXRA | P19793 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
| ▸ | RXRB | P28702 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | RXRG | P48443 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL891912 | 0.89 | ALDH1A1 (0.55) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL160941 | 0.89 | ALDH1A1 (0.55) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL2857543 | 0.84 | ALDH1A1 (0.60) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL2857545 | 0.84 | ALDH1A1 (0.60) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL12494396 | 0.82 | ALDH1A1 (0.56) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL22245027 | 0.82 | ALDH1A1 (0.52) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL5127833 | 0.82 | ALDH1A1 (0.46) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL3721176 | 0.82 | ALDH1A1 (0.46) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL244550 | 0.79 | ALDH1A1 (0.54) | ALDH1A1CYP3A4ALOX15TDP1KDM4E | |
| SCHEMBL17923373 | 0.78 | ALDH1A1 (0.60) | ALDH1A1CYP3A4ALOX15TDP1KDM4E |
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-2417095-B1 | CARBOXYLIC DERIVATIVES AS VIOLET AND/OR WOODY ODORANT | FIRMENICH & CIE (CH) | 2015-01-14 | — | — | EP | disclosed |
| US-8183194-B2 | Carboxylic derivatives as violet and/or woody odorant | FIRMENICH SA (CH) | 2012-05-22 | — | — | US | disclosed |
| WO-2010116286-A1 | CARBOXYLIC DERIVATIVES AS VIOLET AND/OR WOODY ODORANT | FIRMENICH SA (CH) | 2010-10-14 | — | — | WO | disclosed |