Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 7/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.45 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.45 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.45 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.45 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.45 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.45 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.45 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.45 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.45 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.45 |
| ▸ | CYP4F8 | P98187 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7701500 | 0.91 | GPBAR1 (0.47) | GPBAR1CYP3A4CYP2C19CYP1A1CYP1A2 | |
| SCHEMBL7701519 | 0.85 | KDM4E (0.52) | GPBAR1CYP3A4CYP2C19CYP1A1CYP1A2 | |
| SCHEMBL7696153 | 0.83 | ALDH1A1 (0.47) | CYP3A4CYP2C19CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7699568 | 0.83 | GPBAR1 (0.44) | GPBAR1CYP3A4CYP2C19CYP1A1CYP1A2 | |
| SCHEMBL7703305 | 0.81 | GPBAR1 (0.53) | GPBAR1KDM4EKMT2AALDH1A1HPGD | |
| SCHEMBL7703225 | 0.79 | IKBKB (0.46) | GPBAR1KDM4EALDH1A1HPGDPOLB | |
| SCHEMBL7701209 | 0.79 | NPC1 (0.51) | KDM4EALDH1A1HPGDHSD17B10NPC1 | |
| SCHEMBL7701025 | 0.77 | IKBKB (0.45) | GPBAR1KDM4EKMT2AALDH1A1HPGD | |
| SCHEMBL7705474 | 0.77 | IKBKB (0.42) | GPBAR1KDM4EALDH1A1HPGDDGAT1 | |
| SCHEMBL7698844 | 0.76 | KDM4E (0.57) | CYP2C19KDM4EKMT2AALDH1A1HPGD |
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-2002064558-A2 | OXAZOLE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS CYTOKINE INHIBITORS | SANKYO COMPANY, LIMITED (JP) | 2002-08-22 | — | — | WO | disclosed |