Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 10/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 6/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10241939 | 0.93 | CYP3A4 (0.51) | ROCK2ROCK1CYP3A4CYP2C8 | |
| SCHEMBL10241977 | 0.86 | CYP3A4 (0.49) | ROCK2ROCK1CYP3A4CYP2C8 | |
| SCHEMBL17340649 | 0.82 | CYP3A4 (0.42) | CYP3A4CYP2C8 | |
| SCHEMBL17340648 | 0.82 | HPGDS (0.45) | ROCK2CYP3A4CYP2C8 | |
| SCHEMBL10240167 | 0.81 | CYP3A4 (0.53) | ROCK2CYP3A4CYP2C8 | |
| SCHEMBL10280748 | 0.81 | CYP3A4 (0.50) | ROCK2ROCK1CYP3A4CYP2C8 | |
| SCHEMBL10280771 | 0.79 | CYP3A4 (0.48) | CYP3A4CYP2C8 | |
| SCHEMBL10242010 | 0.79 | CYP3A4 (0.48) | ROCK2ROCK1CYP3A4CYP2C8 | |
| SCHEMBL10241946 | 0.78 | CYP3A4 (0.49) | ROCK2ROCK1CYP3A4CYP2C8 | |
| SCHEMBL10242000 | 0.78 | CYP3A4 (0.49) | ROCK2ROCK1CYP3A4CYP2C8 |
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-2326633-B1 | COMPOUNDS FOR THE TREATMENT OF HEPATITIS C | BRISTOL MYERS SQUIBB CO (US) | 2015-12-16 | — | — | EP | disclosed |