Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.41 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.41 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.41 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.41 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.41 |
| ▸ | CYP4F8 | P98187 | 1/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5862035 | 0.82 | PRMT1 (0.40) | CYP3A4CYP2D6CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL5861037 | 0.81 | PRMT1 (0.37) | CYP3A4CYP2D6CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL3111585 | 0.79 | CYP1A1 (0.43) | CYP3A4CYP2D6CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL5862769 | 0.77 | HRH3 (0.42) | CYP3A4CYP2D6CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL5861211 | 0.76 | CYP1A1 (0.41) | CYP3A4CYP2D6CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL6167550 | 0.76 | FFAR1 (0.44) | CYP3A4CYP2D6CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL5860678 | 0.76 | PPARD (0.60) | — | |
| SCHEMBL6166173 | 0.76 | HIF1A (0.46) | CYP3A4CYP2C19NR1H2NR1H3HIF1A | |
| SCHEMBL6165133 | 0.75 | CYP1A1 (0.41) | CYP3A4CYP2D6CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL3107826 | 0.75 | CYP1A1 (0.40) | CYP3A4CYP2D6CYP1A1CYP1A2CYP2E1 |
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-1392674-B1 | FURAN AND THIOPHENE DERIVATIVES THAT ACTIVATE HUMAN PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS | SMITHKLINE BEECHAM CORP (US) | 2005-08-10 | — | — | EP | disclosed |