Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | RARB | P10826 | 5/20 | 0.46 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | RARA | P10276 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MTOR | P42345 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6266720 | 0.90 | RARB (0.50) | MAOAMAOBPPARATSHRRARB | |
| Dodecane SCHEMBL7587924 | 0.85 | TP53 (0.57) | PTPN11PPARATP53TSHRRARB | |
| Tridecane SCHEMBL27836215 | 0.85 | TP53 (0.57) | PTPN11PPARATP53TSHRRARB | |
| SCHEMBL8659026 | 0.82 | TP53 (0.64) | MAOAMAOBTP53ALDH1A1MAPT | |
| SCHEMBL10762716 | 0.82 | RARB (0.57) | TP53TSHRRARBPLA2G4BMEN1 | |
| SCHEMBL10761149 | 0.82 | RARB (0.57) | TP53TSHRRARBPLA2G4BMEN1 | |
| SCHEMBL10767369 | 0.82 | RARB (0.57) | TP53TSHRRARBPLA2G4BMEN1 | |
| SCHEMBL9645497 | 0.80 | GAA (0.58) | TP53TSHRRARBPLA2G4BMEN1 | |
| SCHEMBL2482695 | 0.79 | HPGD (0.56) | PTPN11TSHRPLA2G4BALDH1A1 | |
| SCHEMBL30317186 | 0.79 | HPGD (0.56) | PTPN11TSHRPLA2G4BALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1226113-A1 | ESTERS COMPRISING A SECONDARY CARBAMOYL FUNCTION AND THEIR USE AS ODORANT ALCOHOL PRECURSORS | Firmenich S.A. (CH) | 2002-07-31 | — | — | EP | disclosed |
| WO-2001028980-A1 | ESTERS COMPRISING A SECONDARY CARBAMOYL FUNCTION AND THEIR USE AS ODORANT ALCOHOL PRECURSORS | FIRMENICH S.A. (CH) | 2001-04-26 | — | — | WO | disclosed |