Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 4/20 | 0.56 |
| ▸ | CTSK | P43235 | 2/20 | 0.56 |
| ▸ | CTSL | P07711 | 1/20 | 0.56 |
| ▸ | CTSB | P07858 | 1/20 | 0.56 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.55 |
| ▸ | KLK7 | P49862 | 1/20 | 0.55 |
| ▸ | ACE | P12821 | 1/20 | 0.52 |
| ▸ | REN | P00797 | 4/20 | 0.52 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.50 |
| ▸ | AKT1 | P31749 | 1/20 | 0.50 |
| ▸ | MMP9 | P14780 | 1/20 | 0.50 |
| ▸ | PPARA | Q07869 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL27510152 | 0.95 | CTSS (0.53) | CTSSCTSKCTSLCTSBKLK5 | |
| SCHEMBL30375069 | 0.95 | KLK5 (0.60) | CTSSCTSKCTSLCTSBKLK5 | |
| SCHEMBL21269701 | 0.95 | KLK5 (0.60) | CTSSCTSKCTSLCTSBKLK5 | |
| SCHEMBL27487264 | 0.95 | KLK5 (0.60) | CTSSCTSKCTSLCTSBKLK5 | |
| SCHEMBL9220259 | 0.94 | REN (0.55) | CTSSCTSKCTSLCTSBKLK5 | |
| SCHEMBL27487988 | 0.92 | CTSS (0.65) | CTSSCTSKCTSLCTSBKLK5 | |
| SCHEMBL3821800 | 0.92 | CTSS (0.65) | CTSSCTSKCTSLCTSBKLK5 | |
| SCHEMBL27487987 | 0.92 | CTSS (0.65) | CTSSCTSKCTSLCTSBKLK5 | |
| SCHEMBL7205174 | 0.92 | REN (0.61) | CTSSCTSKCTSLCTSBKLK5 | |
| SCHEMBL27489033 | 0.91 | KLK5 (0.56) | CTSSCTSKCTSLCTSBKLK5 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0445796-B1 | Derivatives of acetic acid containing peptide bonds | HOFFMANN LA ROCHE (CH) | 1998-06-17 | — | — | EP | disclosed |
| US-5430024-A | Peptides bearing N-terminal amidino moieties and their use as inhibitors of platelet aggregation | HOFFMANN-LA ROCHE INC. (US) | 1995-07-04 | — | — | US | disclosed |
| US-5273982-A | An amidinoaryleneamidoalkylpiperazinyleneacetic acid | HOFFMANN-LA ROCHE INC. (US) | 1993-12-28 | — | — | US | disclosed |
| EP-0445796-A2 | Derivatives of acetic acid | F. HOFFMANN-LA ROCHE AG (CH) | 1991-09-11 | — | — | EP | disclosed |