Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | MME | P08473 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
| ▸ | CPA1 | P15085 | 1/20 | 0.39 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10616999 | 0.90 | EPHX1 (0.41) | IDO1TDP1CYP1A2CYP2D6EPHX1 | |
| SCHEMBL3966885 | 0.79 | EPHX2 (0.44) | IDO1TDP1EPHX2MMEACE | |
| SCHEMBL11868464 | 0.76 | EPHX1 (0.43) | IDO1TDP1EPHX2MMEACE | |
| SCHEMBL3289204 | 0.76 | DPP4 (0.49) | IDO1TDP1EPHX2CYP2D6EPHX1 | |
| SCHEMBL10716724 | 0.76 | DPP4 (0.49) | IDO1TDP1EPHX2CYP2D6EPHX1 | |
| SCHEMBL8806240 | 0.76 | SIGMAR1 (0.46) | TDP1EPHX2CYP2D6TAAR1SIGMAR1 | |
| SCHEMBL31494761 | 0.76 | CYP2D6 (0.52) | TDP1EPHX2L3MBTL1CYP2D6TAAR1 | |
| SCHEMBL2467478 | 0.74 | MEN1 (0.53) | IDO1TDP1EPHX2L3MBTL1CYP1A2 | |
| SCHEMBL3285405 | 0.73 | EPHX1 (0.50) | IDO1TDP1CYP2D6EPHX1TAAR1 | |
| SCHEMBL16191154 | 0.73 | TDP1 (0.43) | TDP1EPHX2L3MBTL1SIGMAR1 |
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-0049120-B1 | PHENETHYLETHER DERIVATIVES, PROCESS FOR PREPARING SAME AND USES THEREOF IN COMBATTING TOBACCO BEETLES AND IN AUGMENTING OR ENHANCING THE AROMA OF PERFUMES, COLOGNES AND PERFUMED ARTICLES | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1985-01-16 | — | — | EP | claimed |