Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 3/20 | 0.94 |
| ▸ | HPGD | P15428 | 3/20 | 0.82 |
| ▸ | LMNA | P02545 | 1/20 | 0.82 |
| ▸ | AURKA | O14965 | 1/20 | 0.73 |
| ▸ | PRKACA | P17612 | 2/20 | 0.68 |
| ▸ | PRKX | P51817 | 2/20 | 0.68 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.68 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.68 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.68 |
| ▸ | GSK3A | P49840 | 1/20 | 0.68 |
| ▸ | GSK3B | P49841 | 1/20 | 0.68 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.68 |
| ▸ | GAA | P10253 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.66 |
| ▸ | USP2 | O75604 | 2/20 | 0.66 |
| ▸ | MEN1 | O00255 | 2/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL31061610 | 0.97 | MMP13 (1.00) | MMP13HPGDLMNAAURKAPRKACA | |
| SCHEMBL5332068 | 0.97 | MMP13 (1.00) | MMP13HPGDLMNAAURKAPRKACA | |
| SCHEMBL7134254 | 0.93 | MMP13 (0.86) | MMP13HPGDLMNAAURKAPRKACA | |
| SCHEMBL2922655 | 0.93 | MMP13 (0.81) | MMP13HPGDLMNAAURKAGAA | |
| SCHEMBL5332456 | 0.92 | MMP13 (0.89) | MMP13HPGDLMNAAURKAPRKACA | |
| SCHEMBL12813045 | 0.90 | MMP13 (0.82) | MMP13HPGDLMNAAURKAPRKACA | |
| SCHEMBL9416562 | 0.90 | MMP13 (0.76) | MMP13HPGDLMNAAURKAGAA | |
| SCHEMBL5337912 | 0.89 | MMP13 (0.85) | MMP13HPGDLMNAAURKAPRKACA | |
| SCHEMBL5334260 | 0.89 | MMP13 (0.85) | MMP13HPGDLMNAAURKAPRKACA | |
| SCHEMBL5335899 | 0.88 | MMP13 (0.82) | MMP13HPGDLMNAAURKAPRKACA |
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-0613879-A1 | PHELLODENDRINE ANALOGS AND ALLERGY TYPE IV SUPPRESSOR CONTAINING THE SAME AS ACTIVE INGREDIENT | TSUMURA & CO. (JP) | 1994-09-07 | — | — | EP | disclosed |