Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB1 | P15086 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL6127603 | 1.00 | CPB1 (0.56) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL16199089 | 1.00 | CPB1 (0.56) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL26666261 | 0.95 | CPB1 (0.58) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL9941794 | 0.95 | CPB1 (0.58) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL9938183 | 0.95 | CPB1 (0.58) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL1756904 | 0.95 | CPB1 (0.58) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL1756902 | 0.95 | CPB1 (0.58) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL16199073 | 0.95 | CPB1 (0.58) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL9940952 | 0.89 | ALDH1A1 (0.54) | CPB1ALDH1A1GAATSHREPHX1 | |
| SCHEMBL8759009 | 0.88 | CPB1 (0.58) | CPB1ALDH1A1GAATSHREPHX1 |
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-8871774-B2 | Inhibitors of influenza viruses replication | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2014-10-28 | — | — | US | disclosed |