Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 5/20 | 0.41 |
| ▸ | MMP3 | P08254 | 5/20 | 0.41 |
| ▸ | CTSK | P43235 | 2/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | MME | P08473 | 6/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.37 |
| ▸ | CTSG | P08311 | 1/20 | 0.37 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.37 |
| ▸ | CMA1 | P23946 | 1/20 | 0.37 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.37 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.37 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL15563835 | 0.91 | MME (0.44) | MMP2MMP3MMEACE | |
| SCHEMBL16974296 | 0.84 | MMP2 (0.43) | MMP2MMP3MMEACE | |
| SCHEMBL15564592 | 0.83 | MMP3 (0.52) | MMP2MMP3CTSKPPARAMME | |
| SCHEMBL15564104 | 0.81 | MMEL1 (0.46) | MMP2MMP3CTSKMME | |
| SCHEMBL15563642 | 0.80 | MMEL1 (0.49) | MMP2MMP3CTSKMMEACE | |
| SCHEMBL12481766 | 0.76 | MMP2 (0.52) | MMP2MMP3CTSKMMEACE | |
| SCHEMBL16975190 | 0.73 | MME (0.47) | MME | |
| SCHEMBL22018890 | 0.73 | SYK (0.40) | CTSKPPARAMMEACE | |
| SCHEMBL19407212 | 0.73 | SYK (0.40) | CTSKPPARAMMEACE | |
| SCHEMBL19407213 | 0.72 | MME (0.39) | MMEACE |
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-3256446-A1 | (2S, 4R)-5-(5'-CHLORO-2'-FLUOROBIPHENYL-4-YL)-2-ETHOXYOXALYLAMINO)-2-HYDROXYMETHYL-2-METHYLPENTANOIC ACID AS NEPRILYSIN INHIBITOR | Theravance Biopharma R&D IP, LLC (US) | 2017-12-20 | — | — | EP | disclosed |
| WO-2016130650-A1 | (2S, 4R)-5-(5'-CHLORO-2'-FLUOROBIPHENYL-4-YL)-2-ETHOXYOXALYLAMINO)-2-HYDROXYMETHYL-2-METHYLPENTANOIC ACID AS NEPRILYSIN INHIBITOR | THERAVANCE BIOPHARMA R&D IP, LLC (US) | 2016-08-18 | — | — | WO | disclosed |