Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 7/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.39 |
| ▸ | MC4R | P32245 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8335178 | 0.99 | SLC9A1 (0.40) | SLC9A1KCNH2MC4RCYP3A4CYP2C9 | |
| SCHEMBL9018699 | 0.84 | SLC9A1 (0.41) | SLC9A1KCNH2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL9018725 | 0.81 | SLC9A1 (0.49) | SLC9A1KCNH2 | |
| SCHEMBL8428729 | 0.80 | SLC9A1 (0.48) | SLC9A1KCNH2 | |
| SCHEMBL7797861 | 0.79 | SLC9A1 (0.47) | SLC9A1KCNH2 | |
| SCHEMBL8426434 | 0.79 | SLC9A1 (0.44) | SLC9A1KCNH2 | |
| Hydrochloric Acid SCHEMBL8337106 | 0.79 | SLC9A1 (0.47) | SLC9A1KCNH2 | |
| Hydrochloric Acid SCHEMBL7791916 | 0.78 | SLC9A1 (0.46) | SLC9A1KCNH2 | |
| SCHEMBL8430503 | 0.78 | SMN1; SMN2 (0.33) | CYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL8332844 | 0.77 | SLC9A1 (0.43) | SLC9A1KCNH2 |
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-0791577-B1 | Ortho-substituted benzylguanidines, process for their preparation and their use as medicament or diagnostic agent as well as medicament containing them | HOECHST AG (DE) | 1999-11-03 | — | — | EP | claimed |