Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL771675 | 0.93 | CYP3A4 (0.38) | CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6 | |
| SCHEMBL2200713 | 0.93 | CYP3A4 (0.44) | CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6 | |
| SCHEMBL774427 | 0.92 | CYP3A4 (0.39) | CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6 | |
| SCHEMBL12429115 | 0.92 | CYP3A4 (0.38) | CYP3A4CYP2C9CYP2C19CYP1A2CYP2D6 | |
| SCHEMBL3841663 | 0.83 | KCNH2 (0.38) | CYP3A4CYP2C9CYP2C19KCNH2NR1I2 | |
| SCHEMBL773151 | 0.83 | KCNH2 (0.38) | CYP3A4CYP2C9CYP2C19KCNH2NR1I2 | |
| SCHEMBL2203659 | 0.82 | KCNH2 (0.38) | CYP3A4CYP2C9CYP2C19KCNH2NR1I2 | |
| SCHEMBL12429113 | 0.82 | KCNH2 (0.39) | CYP3A4CYP2C9CYP2C19KCNH2NR1I2 | |
| SCHEMBL3779164 | 0.81 | GAA (0.45) | TRPV1GAAPOLBKMT2ACTDSP1 | |
| SCHEMBL772860 | 0.80 | NR1I2 (0.38) | CYP3A4CYP2C9CYP2C19KCNH2KMT2A |
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 |