Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.53 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8179683 | 0.81 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2CYP19A1MAPK14KDM4E | |
| SCHEMBL8185434 | 0.80 | SLC9A1 (0.52) | ALDH1A1SMN1; SMN2KDM4EMEN1GAA | |
| SCHEMBL8172578 | 0.79 | SLC9A1 (0.50) | — | |
| SCHEMBL8474697 | 0.79 | PTGS1 (0.46) | ALDH1A1KDM4EMEN1GAAMAPK1 | |
| SCHEMBL8183089 | 0.78 | SMN1; SMN2 (0.47) | ALDH1A1SMN1; SMN2KDM4EMEN1GAA | |
| SCHEMBL8832380 | 0.78 | KDM4E (0.45) | ALDH1A1KDM4EMEN1GAAMAPK1 | |
| SCHEMBL8170154 | 0.78 | SMN1; SMN2 (0.46) | ALDH1A1SMN1; SMN2KDM4EMEN1GAA | |
| SCHEMBL8177782 | 0.77 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2CYP19A1 | |
| SCHEMBL5565443 | 0.76 | ALDH1A1 (0.73) | ALDH1A1SMN1; SMN2CYP19A1MAPK14KDM4E | |
| Hydrochloric Acid SCHEMBL8506934 | 0.74 | ALDH1A1 (0.49) | ALDH1A1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6022883-A | Heterocyclyloxybenzoylguanidines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2000-02-08 | — | — | US | disclosed |
| EP-0694537-A1 | Heterocyclyloxy- benzoylguanidine derivatives, their preparation and their use as inhibitors of the cellular Na+/H+-antiporter | MERCK PATENT GmbH (DE) | 1996-01-31 | — | — | EP | disclosed |