Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL17530639 | 0.91 | ALDH1A1 (0.40) | ALDH1A1NPC1 | |
| SCHEMBL17530621 | 0.86 | ALDH1A1 (0.38) | ALDH1A1NPC1 | |
| SCHEMBL2464251 | 0.83 | CYP2C8 (0.47) | — | |
| SCHEMBL2466939 | 0.83 | — | — | |
| SCHEMBL17530686 | 0.81 | CYP3A4 (0.33) | — | |
| SCHEMBL1935044 | 0.81 | PPARG (0.36) | — | |
| SCHEMBL1935953 | 0.78 | CYP2C8 (0.46) | — | |
| SCHEMBL3208394 | 0.78 | ALDH1A1 (0.38) | ALDH1A1NPC1 | |
| SCHEMBL1936898 | 0.77 | — | — | |
| SCHEMBL1936405 | 0.77 | CYP2C9 (0.45) | — |
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-2331502-B1 | COMPOUNDS FOR THE TREATMENT OF HEPATITIS C | BRISTOL MYERS SQUIBB CO (US) | 2016-03-02 | — | — | EP | disclosed |