Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 1/20 | 0.39 |
| ▸ | MME | P08473 | 14/20 | 0.39 |
| ▸ | MMEL1 | Q495T6 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | KLK7 | P49862 | 1/20 | 0.35 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18012913 | 1.00 | CACNA1B (0.39) | CACNA1BMMEMMEL1ATMACE | |
| SCHEMBL18012912 | 0.90 | MME (0.43) | MMEMMEL1ACE | |
| SCHEMBL26378137 | 0.87 | MME (0.44) | MMEMMEL1ATMACE | |
| SCHEMBL19705794 | 0.86 | MME (0.50) | MMEMMEL1ATMACE | |
| SCHEMBL17968662 | 0.86 | MME (0.50) | MMEMMEL1ATMACE | |
| SCHEMBL19687937 | 0.85 | MME (0.44) | MMEMMEL1ATMACE | |
| SCHEMBL15467492 | 0.85 | MME (0.44) | MMEMMEL1ATMACE | |
| SCHEMBL19771839 | 0.84 | MME (0.45) | MMEMMEL1ATMACE | |
| SCHEMBL26382242 | 0.82 | MME (0.44) | MMEMMEL1ATMACE | |
| SCHEMBL16689437 | 0.82 | CTSS (0.44) | MMEATMACEPTPN1KLK5 |
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-3256446-B1 | (2S,4R)-5-(5'-CHLORO-2'-FLUOROBIPHENYL-4-YL)-4-(ETHOXYOXALYLAMINO)-2-HYDROXYMETHYL-2-METHYLPENTANOIC ACID AS NEPRILYSIN INHIBITOR | THERAVANCE BIOPHARMA R&D IP LLC (US) | 2022-05-18 | — | — | EP | disclosed |