Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | KLK5 | Q9Y337 | 3/20 | 0.38 |
| ▸ | CTSK | P43235 | 6/20 | 0.37 |
| ▸ | CTSS | P25774 | 3/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.37 |
| ▸ | CTSB | P07858 | 1/20 | 0.37 |
| ▸ | PTPRB | P23467 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | ACE | P12821 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | REN | P00797 | 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 | |
|---|---|---|---|---|
| SCHEMBL9373974 | 0.91 | PTPRB (0.39) | ATMKLK5CTSKCTSSCTSL | |
| SCHEMBL9379291 | 0.91 | ATM (0.39) | ATMKLK5CTSKCTSSCTSL | |
| SCHEMBL6666632 | 0.88 | ALDH1A1 (0.40) | ATMKLK5CTSKCTSSCTSL | |
| SCHEMBL6666961 | 0.87 | ALDH1A1 (0.39) | ATMKLK5CTSKCTSSCTSL | |
| SCHEMBL6668504 | 0.87 | ALDH1A1 (0.39) | ATMKLK5CTSKCTSSCTSL | |
| SCHEMBL9378904 | 0.87 | CTSS (0.41) | ATMKLK5CTSKCTSSCTSL | |
| SCHEMBL9373933 | 0.87 | CTSK (0.39) | ATMKLK5CTSKCTSSCTSL | |
| SCHEMBL6663482 | 0.86 | KLK5 (0.41) | ATMKLK5CTSKCTSSCTSL | |
| SCHEMBL6664868 | 0.86 | CTSK (0.41) | ATMKLK5CTSKALDH1A1REN | |
| SCHEMBL6692480 | 0.84 | ADRB2 (0.38) | ATMKLK5CTSKCTSSCTSL |
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-0603309-A1 | PEPTIDE ISOTERS CONTAINING A HETEROCYCLE AS H.I.V. INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 1994-06-29 | — | — | EP | disclosed |