Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | GLS | O94925 | 1/20 | 0.33 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 3/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | TKT | P29401 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | EP300 | Q09472 | 1/20 | 0.31 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.31 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.31 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.31 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1743303 | 0.76 | TRPV3 (0.41) | CYP2C9CYP3A4PPARDCYP2C8CYP2D6 | |
| SCHEMBL1744297 | 0.76 | KCNQ3 (0.37) | CYP2C9CYP3A4PPARDCYP2C8CYP2D6 | |
| SCHEMBL3644221 | 0.75 | TRPV3 (0.42) | CYP2C9CYP3A4PPARDCYP2C8CYP2D6 | |
| SCHEMBL1519770 | 0.75 | CYP2C9 (0.36) | CYP2C9CYP3A4PPARDCYP2C8CYP2D6 | |
| SCHEMBL1742507 | 0.74 | KCNQ3 (0.36) | CYP2C9CYP3A4PPARDCYP2C8CYP2D6 | |
| SCHEMBL3636064 | 0.74 | MME (0.36) | CYP2C9CYP3A4PPARDCYP2C8CYP2D6 | |
| SCHEMBL1742045 | 0.69 | HDAC1 (0.38) | CYP2C9CYP2C8CYP2D6CYP2C19ADORA2A | |
| SCHEMBL1744294 | 0.67 | HDAC1 (0.36) | CYP2C9CYP3A4PPARDCYP2C8CYP2D6 | |
| SCHEMBL1745648 | 0.67 | MAPK1 (0.40) | CYP2C9CYP3A4PPARDCYP2C8CYP2D6 | |
| SCHEMBL3511879 | 0.65 | BACE1 (0.52) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2167504-A2 | THIADIAZOLE MODULATORS OF PKB | Amgen, Inc (US) | 2010-03-31 | — | — | EP | disclosed |
| WO-2009011871-A2 | THIADIAZOLE MODULATORS OF PKB | AMGEN INC. (US) | 2009-01-22 | — | — | WO | disclosed |