Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 7/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | PTPRB | P23467 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PRKCA | P17252 | 1/20 | 0.34 |
| ▸ | MMP12 | P39900 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12429113 | 0.96 | KCNH2 (0.39) | KCNH2NR1I2CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL773151 | 0.93 | KCNH2 (0.38) | KCNH2NR1I2CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL12429109 | 0.93 | PTPN1 (0.38) | KCNH2NR1I2CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL2203659 | 0.91 | KCNH2 (0.38) | KCNH2NR1I2CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL772860 | 0.89 | NR1I2 (0.38) | KCNH2NR1I2CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL3778289 | 0.88 | KCNH2 (0.38) | KCNH2NR1I2CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL4051516 | 0.86 | KCNH2 (0.40) | KCNH2NR1I2CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL2200713 | 0.84 | CYP3A4 (0.44) | KCNH2NR1I2CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL10283254 | 0.83 | KCNH2 (0.39) | KCNH2NR1I2CYP3A4CYP2C19CYP2C9 | |
| SCHEMBL2201045 | 0.83 | CYP3A4 (0.37) | KCNH2NR1I2CYP3A4CYP2C19CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2206715-A1 | Fused heterotetracyclic compounds and use thereof as hcv polymerase inhibitor | Japan Tobacco, Inc. (JP) | 2010-07-14 | — | — | EP | disclosed |
| EP-1719773-B1 | FUSED HETEROTETRACYCLIC COMPOUNDS AND USE TEHREOF AS HCV POLYMERASE INHIBITOR | JAPAN TOBACCO INC (JP) | 2009-04-15 | — | — | EP | disclosed |
| EP-1719773-A1 | FUSED HETEROTETRACYCLIC COMPOUNDS AND USE TEHREOF AS HCV POLYMERASE INHIBITOR | Japan Tobacco, Inc. (JP) | 2006-11-08 | — | — | EP | disclosed |