Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT1 | P54687 | 18/20 | 0.42 |
| ▸ | BCAT2 | O15382 | 16/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8948538 | 0.79 | PDE4A (0.31) | — | |
| SCHEMBL8304983 | 0.77 | ALDH1A1 (0.40) | BCAT1BCAT2ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL8783704 | 0.76 | BCAT1 (0.46) | BCAT1BCAT2ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL6966995 | 0.74 | BCAT1 (0.50) | BCAT1BCAT2ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL8191210 | 0.73 | BCAT1 (0.43) | BCAT1BCAT2ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL9781202 | 0.72 | PDE4A (0.35) | — | |
| SCHEMBL8193914 | 0.72 | BCAT1 (0.41) | BCAT1BCAT2ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL9379682 | 0.70 | BCAT1 (0.54) | BCAT1BCAT2ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL8335837 | 0.70 | BCAT1 (0.42) | BCAT1BCAT2ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL6844291 | 0.70 | PDE4A (0.31) | — |
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-5521147-A | HERBICIDES | FMC CORPORATION (US) | 1996-05-28 | — | — | US | disclosed |