Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.46 |
| ▸ | CDK2 | P24941 | 2/20 | 0.46 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | DHFR | P00374 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | CTSC | P53634 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6980125 | 0.83 | CYP3A4 (0.51) | CYP3A4CYP2D6CYP1A2CYP2C19TSHR | |
| SCHEMBL13570515 | 0.83 | CYP3A4 (0.51) | CYP3A4CYP2D6CYP1A2CYP2C19TSHR | |
| SCHEMBL13570392 | 0.80 | CYP3A4 (0.49) | CYP3A4CYP2D6CYP1A2CYP2C19TSHR | |
| SCHEMBL13570579 | 0.79 | CYP3A4 (0.51) | CYP3A4CYP2D6CYP1A2CYP2C19TSHR | |
| SCHEMBL976838 | 0.75 | RECQL (0.62) | CYP3A4CYP2D6CYP1A2CYP2C19TSHR | |
| SCHEMBL7313727 | 0.75 | RECQL (0.62) | CYP3A4CYP2D6CYP1A2CYP2C19TSHR | |
| SCHEMBL7313737 | 0.75 | RECQL (0.62) | CYP3A4CYP2D6CYP1A2CYP2C19TSHR | |
| SCHEMBL24057819 | 0.74 | LMNA (0.60) | CYP3A4CYP2D6CYP1A2CYP2C19TSHR | |
| SCHEMBL7305357 | 0.74 | LMNA (0.60) | CYP3A4CYP2D6CYP1A2CYP2C19TSHR | |
| SCHEMBL24056571 | 0.74 | LMNA (0.60) | CYP3A4CYP2D6CYP1A2CYP2C19TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2519506-A1 | HEPATITIS C VIRUS INHIBITORS | Bristol-Myers Squibb Company (US) | 2012-11-07 | — | — | EP | claimed |
| WO-2011082077-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2011-07-07 | — | — | WO | claimed |