Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR2 | P50052 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | ACE | P12821 | 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 | |
|---|---|---|---|---|
| SCHEMBL4652403 | 0.85 | KMT2A (0.39) | — | |
| SCHEMBL5252852 | 0.72 | ACE (0.43) | HTTACE | |
| SCHEMBL4696326 | 0.70 | AGTR2 (0.33) | AGTR2HTT | |
| SCHEMBL4696355 | 0.66 | AGTR2 (0.32) | AGTR2HTT | |
| SCHEMBL5253340 | 0.65 | PLK1 (0.36) | — | |
| SCHEMBL28681399 | 0.63 | HHAT (0.46) | ACE | |
| SCHEMBL17423108 | 0.61 | MAP1LC3B (0.32) | — | |
| SCHEMBL19064715 | 0.61 | MAP1LC3B (0.32) | — | |
| SCHEMBL19064713 | 0.61 | MAP1LC3B (0.32) | — | |
| SCHEMBL5023851 | 0.59 | ACE (0.66) | ACE |
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 |
|---|---|---|---|---|---|---|---|
| EP-1569935-B1 | HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREOF AND USE OF SAME AS MEDICAMENTS, SUCH AS ANTI-BACTERIAL MEDICAMENTS AND BETA-LACTAMASE INHIBITORS | NOVEXEL (FR) | 2008-08-20 | — | — | EP | disclosed |
| EP-1798231-A2 | Intermediate products for the preparation of antibacterial compounds | NOVEXEL (FR) | 2007-06-20 | — | — | EP | disclosed |