Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 5/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.40 |
| ▸ | RARG | P13631 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7291272 | 0.88 | CYP1A2 (0.38) | PPARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7284671 | 0.88 | CYP1A2 (0.38) | PPARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7370508 | 0.86 | CYP1A2 (0.37) | PPARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7290272 | 0.85 | MME (0.43) | ACE | |
| SCHEMBL7283576 | 0.82 | CYP1A2 (0.39) | PPARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7283663 | 0.82 | CYP3A4 (0.35) | PPARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7283657 | 0.82 | CYP3A4 (0.35) | PPARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9400825 | 0.82 | CYP3A4 (0.35) | PPARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7378978 | 0.80 | CYP3A4 (0.34) | PPARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7283659 | 0.80 | ECE1 (0.38) | PPARACYP3A4CYP1A2CYP2D6CYP2C9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0341081-B1 | Novel amino acid derivatives | ONO PHARMACEUTICAL CO (JP) | 1995-07-05 | — | — | EP | disclosed |
| US-5317021-A | Analgesics, anticonvulsants | ONO PHARMACEUTICAL CO., LTD. (JP) | 1994-05-31 | — | — | US | disclosed |
| US-5202340-A | Analgesics, anticonvulsants, anxiolytic agents, inhibitors for enkephalinases | ONO PHARMACEUTICAL CO., LTD. (JP) | 1993-04-13 | — | — | US | disclosed |
| US-5017589-A | Analgesic, antianxiety, anticonvulsant | ONO PHARMACEUTICAL CO., LTD. (JP) | 1991-05-21 | — | — | US | disclosed |