Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 16/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 15/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | PRKCA | P17252 | 1/20 | 0.44 |
| ▸ | MMP12 | P39900 | 1/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL772009 | 0.91 | CYP3A4 (0.55) | CYP3A4CYP2C19CYP2C9CYP2D6PRKCA | |
| SCHEMBL772010 | 0.91 | CYP3A4 (0.55) | CYP3A4CYP2C19CYP2C9CYP2D6PRKCA | |
| SCHEMBL772004 | 0.86 | PRKCA (0.52) | CYP3A4CYP2C19CYP2C9CYP2D6PRKCA | |
| SCHEMBL12428925 | 0.84 | PRKCA (0.51) | CYP3A4CYP2C19CYP2C9CYP2D6PRKCA | |
| SCHEMBL771866 | 0.84 | PRKCA (0.51) | CYP3A4CYP2C19CYP2C9CYP2D6PRKCA | |
| Hydrochloric Acid SCHEMBL773615 | 0.83 | PRKCA (0.51) | CYP3A4CYP2C19CYP2C9CYP2D6PRKCA | |
| SCHEMBL773368 | 0.82 | PRKCA (0.52) | CYP3A4CYP2C19CYP2C9CYP2D6PRKCA | |
| SCHEMBL772881 | 0.82 | PRKCA (0.52) | CYP3A4CYP2C19CYP2C9CYP2D6PRKCA | |
| SCHEMBL3778315 | 0.82 | PRKCA (0.51) | CYP3A4CYP2C19CYP2C9CYP2D6PRKCA | |
| SCHEMBL774194 | 0.82 | PRKCA (0.47) | CYP3A4CYP2C19CYP2C9CYP2D6PRKCA |
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 |
|---|---|---|---|---|---|---|---|
| US-7977331-B1 | Tetracyclic fused heterocyclic compound and use thereof as HCV polymerase inhibitor | JAPAN TOBACCO INC. (JP) | 2011-07-12 | — | — | US | disclosed |