Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKCA | P17252 | 1/20 | 0.36 |
| ▸ | MMP12 | P39900 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 6/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SCN1A | P35498 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.32 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1954944 | 0.90 | PRKCA (0.45) | PRKCAMMP12KCNH2CYP3A4SCN5A | |
| SCHEMBL1981129 | 0.90 | PRKCA (0.37) | PRKCAMMP12KCNH2CYP3A4SCN5A | |
| SCHEMBL1956164 | 0.83 | SCN9A (0.41) | PRKCAMMP12KCNH2CYP3A4SCN5A | |
| SCHEMBL1954720 | 0.82 | PRKCA (0.46) | PRKCAMMP12CYP3A4NR1I2CYP2C9 | |
| SCHEMBL1954406 | 0.79 | PRKCA (0.37) | PRKCAMMP12KCNH2CYP3A4SCN5A | |
| SCHEMBL1980588 | 0.78 | SCN9A (0.36) | PRKCAMMP12CYP3A4NR1I2CYP2C9 | |
| SCHEMBL1953999 | 0.77 | PRKCA (0.45) | PRKCAMMP12CYP3A4NR1I2CYP2C9 | |
| SCHEMBL1981016 | 0.73 | SCN9A (0.36) | PRKCAMMP12CYP3A4NR1I2CYP2C9 | |
| SCHEMBL1957388 | 0.73 | PRKCA (0.40) | PRKCAMMP12CYP3A4NR1I2CYP2C9 | |
| SCHEMBL12595728 | 0.73 | PRKCA (0.34) | PRKCAMMP12CYP3A4NR1I2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2331554-A1 | MACROCYCLIC INDOLE DERIVATIVES USEFUL AS HEPATITIS C VIRUS INHIBITORS | Tibotec Pharmaceuticals (IE) | 2011-06-15 | — | — | EP | disclosed |