Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 5/20 | 0.58 |
| ▸ | CNR2 | P34972 | 4/20 | 0.45 |
| ▸ | CNR1 | P21554 | 2/20 | 0.45 |
| ▸ | OXER1 | Q8TDS5 | 5/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | PPARG | P37231 | 5/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | RXRA | P19793 | 2/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.37 |
| ▸ | PPARD | Q03181 | 4/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.35 |
| ▸ | F7 | P08709 | 3/20 | 0.35 |
| ▸ | F3 | P13726 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL13674213 | 0.78 | PPARA (0.89) | PPARACNR2CNR1OXER1ALDH1A1 | |
| SCHEMBL4445477 | 0.78 | PPARA (0.89) | PPARACNR2CNR1OXER1ALDH1A1 | |
| SCHEMBL4445473 | 0.78 | PPARA (0.89) | PPARACNR2CNR1OXER1ALDH1A1 | |
| SCHEMBL4877054 | 0.73 | PPARA (0.58) | PPARACNR2CNR1OXER1ALDH1A1 | |
| SCHEMBL4877044 | 0.73 | PPARA (0.58) | PPARACNR2CNR1OXER1ALDH1A1 | |
| SCHEMBL2745181 | 0.73 | PPARA (1.00) | PPARACNR2CNR1OXER1ALDH1A1 | |
| SCHEMBL2745188 | 0.73 | PPARA (1.00) | PPARACNR2CNR1OXER1ALDH1A1 | |
| SCHEMBL6405870 | 0.72 | PPARA (0.96) | PPARACNR2CNR1OXER1ALDH1A1 | |
| SCHEMBL2744282 | 0.72 | PPARA (0.96) | PPARACNR2CNR1OXER1ALDH1A1 | |
| SCHEMBL5886676 | 0.72 | PPARA (0.96) | PPARACNR2CNR1OXER1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1496042-B1 | E2, E4,Z8-Undecatrienoic acid and ester and carboxamide derivatives thereof, organoleptic uses thereof and processes for preparing same | INT FLAVORS & FRAGRANCES INC (US) | 2009-11-11 | — | — | EP | disclosed |