Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 8/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 5/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.39 |
| ▸ | PRKCA | P17252 | 1/20 | 0.38 |
| ▸ | MMP12 | P39900 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL771847 | 0.95 | CYP3A4 (0.40) | CYP3A4CYP2C19NR1I2CYP2C9KCNH2 | |
| SCHEMBL772943 | 0.93 | CYP3A4 (0.41) | CYP3A4CYP2C19NR1I2CYP2C9KCNH2 | |
| SCHEMBL774125 | 0.93 | CYP3A4 (0.41) | CYP3A4CYP2C19NR1I2CYP2C9KCNH2 | |
| SCHEMBL772488 | 0.92 | NR1I2 (0.40) | CYP3A4CYP2C19NR1I2CYP2C9KCNH2 | |
| SCHEMBL771380 | 0.92 | NR1I2 (0.40) | CYP3A4CYP2C19NR1I2CYP2C9KCNH2 | |
| SCHEMBL771659 | 0.91 | NR1I2 (0.39) | CYP3A4CYP2C19NR1I2CYP2C9KCNH2 | |
| SCHEMBL773344 | 0.91 | NR1I2 (0.40) | CYP3A4CYP2C19NR1I2CYP2C9KCNH2 | |
| SCHEMBL775190 | 0.90 | ESR1 (0.40) | CYP3A4CYP2C19NR1I2CYP2C9KCNH2 | |
| SCHEMBL2202854 | 0.90 | NR1I2 (0.39) | CYP3A4CYP2C19NR1I2CYP2C9KCNH2 | |
| SCHEMBL772418 | 0.90 | NR1I2 (0.38) | CYP3A4CYP2C19NR1I2CYP2C9KCNH2 |
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 |