Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7382068 | 0.87 | ACE (0.40) | ACE | |
| SCHEMBL7386461 | 0.83 | TSHR (0.50) | ACETSHR | |
| SCHEMBL7386472 | 0.83 | ACE (0.46) | ACE | |
| SCHEMBL7385804 | 0.83 | ACE (0.46) | ACE | |
| SCHEMBL7386691 | 0.82 | ACE (0.42) | ACE | |
| SCHEMBL7386753 | 0.77 | ALDH1A1 (0.40) | ALDH1A1TSHR | |
| SCHEMBL7390342 | 0.77 | TLR4 (0.43) | ALDH1A1TSHR | |
| SCHEMBL7392788 | 0.77 | ACE (0.35) | ACE | |
| SCHEMBL7392789 | 0.77 | ACE (0.35) | ACE | |
| SCHEMBL7386602 | 0.76 | ALDH1A1 (0.37) | ALDH1A1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5426103-A | Endopeptidase inhibitors; condensing macrocylic compound with a thioic acid or salt therof; possible esterification, salt formation, deslating, deprotecting, deesterifying of function-al groups | CIBA-GEIGY CORPORATION (US) | 1995-06-20 | — | — | US | disclosed |
| US-5244889-A | Treatment of cardiovascular disorders | CIBA-GEIGY CORPORATION (US) | 1993-09-14 | — | — | US | disclosed |
| EP-0544620-A1 | Macrocyclic lactams as inhibitors of atrial natriuretic factors (ANF)-degrading neutral endopeptidase (NEP) | CIBA-GEIGY AG (CH) | 1993-06-02 | — | — | EP | disclosed |