Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 8/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.33 |
| ▸ | PLAU | P00749 | 1/20 | 0.33 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.32 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8611408 | 0.92 | SLC9A1 (0.36) | SLC9A1CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL9018663 | 0.88 | SLC9A1 (0.43) | SLC9A1 | |
| SCHEMBL8613937 | 0.82 | SLC9A1 (0.38) | SLC9A1 | |
| SCHEMBL9018721 | 0.79 | PLAU (0.41) | SLC9A1KCNH2PLAU | |
| SCHEMBL9018722 | 0.79 | SLC9A1 (0.45) | SLC9A1KCNH2PLAU | |
| SCHEMBL9018711 | 0.73 | PLAU (0.41) | SLC9A1KCNH2PLAU | |
| SCHEMBL8609018 | 0.72 | SLC9A1 (0.36) | SLC9A1KCNH2PLAU | |
| SCHEMBL9018703 | 0.70 | SLC9A1 (0.43) | SLC9A1CYP2C9CYP2C19CYP2D6CYP3A4 | |
| SCHEMBL9018684 | 0.70 | HTR2B (0.39) | SLC9A1 | |
| SCHEMBL9018667 | 0.70 | SLC9A1 (0.46) | SLC9A1 |
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-0743301-A2 | Benzoylguanidines containing fluorine | MERCK PATENT GmbH (DE) | 1996-11-20 | — | — | EP | disclosed |