Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 9/20 | 0.49 |
| ▸ | MME | P08473 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7326405 | 0.83 | POLB (0.36) | ACEMME | |
| SCHEMBL7326668 | 0.80 | CASP3 (0.36) | ACEALDH1A1 | |
| SCHEMBL3914079 | 0.80 | ACE (0.55) | ACEMMEALDH1A1SMN1; SMN2 | |
| SCHEMBL7427663 | 0.79 | ACE (0.33) | ACE | |
| SCHEMBL7323145 | 0.74 | CASP3 (0.36) | ACEALDH1A1 | |
| SCHEMBL7088511 | 0.73 | ACE (0.56) | ACEMMEALDH1A1SMN1; SMN2CASP1 | |
| SCHEMBL645674 | 0.73 | ACE (0.56) | ACEMMEALDH1A1SMN1; SMN2CASP1 | |
| SCHEMBL7088512 | 0.73 | ACE (0.56) | ACEMMEALDH1A1SMN1; SMN2CASP1 | |
| SCHEMBL7339985 | 0.73 | ACE (0.56) | ACEMMEALDH1A1SMN1; SMN2CASP1 | |
| Water SCHEMBL10565338 | 0.72 | ACE (0.54) | ACEMMEALDH1A1SMN1; SMN2CASP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4826980-A | HYPOTENSIVE AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1989-05-02 | — | — | US | disclosed |
| US-4785093-A | Bicyclic compounds | HOFFMANN-LA ROCHE INC. (US) | 1988-11-15 | — | — | US | disclosed |
| US-4762924-A | HYPOTENSIVE AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1988-08-09 | — | — | US | disclosed |
| US-4743687-A | HYPOTENSIVE AGENTS | HOFFMANN-LA ROCHE INC. (US) | 1988-05-10 | — | — | US | disclosed |
| US-4692438-A | Pyridazo-diazepines, diazocines, and -triazepines having anti-hypertensive activity | HOFFMANN-LA ROCHE INC. (US) | 1987-09-08 | — | — | US | disclosed |