Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8908514 | 0.90 | CYP3A4 (0.54) | — | |
| SCHEMBL9836380 | 0.86 | CYP3A4 (0.57) | HRH3 | |
| SCHEMBL7925394 | 0.84 | SLC6A12 (0.57) | — | |
| SCHEMBL7925390 | 0.84 | SLC6A12 (0.57) | — | |
| Hydrochloric Acid SCHEMBL7917199 | 0.83 | — | — | |
| Hydrochloric Acid SCHEMBL7917197 | 0.83 | — | — | |
| SCHEMBL7925246 | 0.79 | KDM4E (0.60) | — | |
| SCHEMBL7925243 | 0.79 | KDM4E (0.60) | — | |
| SCHEMBL9086175 | 0.79 | SLC6A1 (0.55) | — | |
| SCHEMBL9837079 | 0.77 | KDM4E (0.44) | SMN1; SMN2 |
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-0502031-B1 | N-SUBSTITUTED AZAHETEROCYCLIC CARBOXYLIC ACIDS AND A PHARMACEUTICAL COMPOSITION | NOVO NORDISK AS (DK) | 1997-08-20 | — | — | EP | claimed |