Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 19/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5150318 | 0.80 | TP53 (0.52) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL9847760 | 0.79 | AR (0.50) | AR | |
| SCHEMBL9847759 | 0.78 | TP53 (0.50) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL3419449 | 0.77 | TP53 (0.57) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL8990309 | 0.74 | TP53 (0.44) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL8990487 | 0.73 | TP53 (0.43) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL9847755 | 0.73 | AR (0.48) | AR | |
| SCHEMBL8990354 | 0.72 | TP53 (0.42) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL9847778 | 0.72 | AR (0.49) | AR | |
| SCHEMBL8623452 | 0.70 | AR (0.53) | AR |
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-0413415-A1 | Carboxylic acids and derivates thereof | The British Petroleum Company p.l.c. (GB) | 1991-02-20 | — | — | EP | disclosed |