Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | TOP1 | P11387 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | WRN | Q14191 | 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 | |
|---|---|---|---|---|
| SCHEMBL2437009 | 0.87 | — | — | |
| SCHEMBL1695314 | 0.87 | — | — | |
| SCHEMBL8744195 | 0.85 | NAAA (0.44) | NAAATSHRALDH1A1ALOX15HSD17B10 | |
| SCHEMBL8744192 | 0.85 | NAAA (0.44) | NAAATSHRALDH1A1ALOX15HSD17B10 | |
| SCHEMBL11292223 | 0.85 | NAAA (0.44) | NAAATSHRALDH1A1ALOX15HSD17B10 | |
| SCHEMBL2039597 | 0.83 | NAAA (0.42) | PTGS1NR1I2PGRADORA3PTGS2 | |
| SCHEMBL873463 | 0.83 | NAAA (0.42) | PTGS1NR1I2PGRADORA3PTGS2 | |
| SCHEMBL873462 | 0.83 | NAAA (0.42) | PTGS1NR1I2PGRADORA3PTGS2 | |
| SCHEMBL8565032 | 0.82 | PPARG (0.50) | PTGS1PGRADORA3ALDH1A1ALOX15 | |
| SCHEMBL30870406 | 0.82 | NAAA (0.45) | PTGS1NR1I2PGRADORA3PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016043771-A1 | CYCLOPROPANE DERIVATIVES IN FLAVOR AND FRAGRANCE COMPOSITIONS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2016-03-24 | — | — | WO | disclosed |