Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 18/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 17/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13476369 | 0.93 | CYP3A4 (0.56) | CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL13476317 | 0.90 | CYP3A4 (0.49) | CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL12510453 | 0.87 | CYP3A4 (0.69) | CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL13476316 | 0.86 | CYP3A4 (0.44) | CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL774699 | 0.83 | CYP3A4 (0.57) | CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL774700 | 0.83 | CYP3A4 (0.57) | CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL2157426 | 0.83 | CYP3A4 (0.52) | CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL2157435 | 0.83 | CYP3A4 (0.52) | CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL13476304 | 0.82 | CYP3A4 (0.49) | CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6 | |
| SCHEMBL13476372 | 0.81 | CYP3A4 (0.47) | CYP3A4CYP2C19CYP2C9CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-7659263-B2 | Thienopyrrole compound and use thereof as HCV polymerase inhibitor | JAPAN TOBACCO INC. (JP) | 2010-02-09 | — | — | US | disclosed |
| US-7659263-B2 | Thienopyrrole compound and use thereof as HCV polymerase inhibitor | JAPAN TOBACCO INC. (JP) | 2010-02-09 | — | — | US | disclosed |