Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 20/20 | 0.71 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.71 |
| ▸ | CYP2C9 | P11712 | 7/20 | 0.69 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL7985442 | 0.84 | SLC9A1 (0.53) | SLC9A1CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL6137546 | 0.84 | SLC9A1 (0.53) | SLC9A1CYP2C19CYP3A4CYP2C9CYP2D6 | |
| Sabiporide SCHEMBL1286663 | 0.83 | SLC9A1 (1.00) | SLC9A1CYP2C19CYP3A4CYP2C9CYP2D6 | |
| Sabiporide SCHEMBL1286649 | 0.83 | SLC9A1 (0.98) | SLC9A1CYP2C19CYP3A4CYP2C9CYP2D6 | |
| Sabiporide SCHEMBL4901735 | 0.82 | SLC9A1 (0.96) | SLC9A1CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL6137414 | 0.81 | SLC9A1 (0.48) | SLC9A1CYP2C19CYP3A4CYP2C9 | |
| SCHEMBL7985451 | 0.80 | ALDH1A1 (0.54) | SLC9A1CYP2C19CYP3A4 | |
| Sabiporide SCHEMBL27472449 | 0.79 | SLC9A1 (0.89) | SLC9A1CYP2C19CYP3A4CYP2C9CYP2D6 | |
| Hydrochloric Acid SCHEMBL7837958 | 0.79 | SLC9A1 (0.62) | SLC9A1CYP2C19CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL7985439 | 0.77 | NPY2R (0.46) | SLC9A1CYP2C19CYP3A4CYP2C9 |
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-1165534-B1 | BENZOYLGUANIDINE DERIVATIVES WITH ADVANTAGEOUS PROPERTIES, METHOD FOR PRODUCING THEM AND THEIR USE IN THE PRODUCTION OF MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA (DE) | 2005-02-02 | — | — | EP | claimed |