Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 16/20 | 1.00 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.48 |
| ▸ | MMP3 | P08254 | 1/20 | 0.47 |
| ▸ | MMP9 | P14780 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP12 | P39900 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | SUCNR1 | Q9BXA5 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12498665 | 0.82 | CTSA (1.00) | CTSA | |
| SCHEMBL12804187 | 0.79 | CTSA (1.00) | CTSAMMP3MMP9MMP8MMP12 | |
| SCHEMBL27761114 | 0.76 | CTSA (0.62) | CTSAMMP3MMP9MMP8MMP12 | |
| SCHEMBL5926784 | 0.75 | CTSA (0.60) | CTSAMMP3MMP9MMP8MMP12 | |
| SCHEMBL27927676 | 0.74 | CTSA (0.65) | CTSAMMP3MMP9MMP8MMP12 | |
| SCHEMBL17998322 | 0.74 | CTSA (0.58) | CTSASUCNR1 | |
| SCHEMBL3994930 | 0.73 | CTSA (0.57) | CTSAMMP12SUCNR1 | |
| SCHEMBL5692215 | 0.73 | CTSA (0.57) | CTSAMMP3MMP9MMP8MMP12 | |
| SCHEMBL12498844 | 0.72 | CTSA (0.85) | CTSA | |
| SCHEMBL12498839 | 0.72 | CTSA (0.85) | CTSA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014053533-A1 | USE OF SUBSTITUTED 3-HETEROAROYLAMINO-PROPIONIC ACID DERIVATIVES AS PHARMACEUTICALS FOR PREVENTION/TREATMENT OF ATRIAL FIBRILLATION | SANOFI (FR) | 2014-04-10 | — | — | WO | disclosed |