Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 9/20 | 0.53 |
| ▸ | LTA4H | P09960 | 5/20 | 0.52 |
| ▸ | ACE2 | Q9BYF1 | 4/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7087531 | 0.94 | ACE (0.56) | ACELTA4HACE2 | |
| SCHEMBL29290359 | 0.94 | ACE (0.56) | ACELTA4HACE2 | |
| Trifluoroacetic Acid SCHEMBL30315360 | 0.88 | LTA4H (0.53) | ACELTA4HACE2 | |
| SCHEMBL12253518 | 0.80 | ACE (0.52) | ACELTA4HACE2 | |
| SCHEMBL31197026 | 0.79 | ACE (0.67) | ACELTA4HACE2 | |
| SCHEMBL27890165 | 0.79 | ACE (0.73) | ACELTA4HACE2 | |
| SCHEMBL27890164 | 0.79 | ACE (0.73) | ACELTA4HACE2 | |
| Trifluoroacetic Acid SCHEMBL3700603 | 0.78 | ACE (0.64) | ACELTA4H | |
| SCHEMBL6436560 | 0.78 | ACE (0.65) | ACELTA4HACE2 | |
| SCHEMBL6438290 | 0.78 | ACE (0.65) | ACELTA4HACE2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104098650-B | The synthesis and application of the intermediate of Atosiban | 中国医学科学院药物研究所 | 2019-04-09 | — | — | CN | disclosed |