Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.48 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 4/20 | 0.46 |
| ▸ | CTSS | P25774 | 5/20 | 0.44 |
| ▸ | CTSK | P43235 | 4/20 | 0.44 |
| ▸ | CTSL | P07711 | 1/20 | 0.44 |
| ▸ | CTSB | P07858 | 1/20 | 0.44 |
| ▸ | ACE | P12821 | 1/20 | 0.43 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL740215 | 1.00 | ATM (0.55) | ATMCYP3A4CYP17A1APPCTSS | |
| SCHEMBL1519945 | 0.88 | ATM (0.70) | ATMCYP3A4APPCTSSCTSK | |
| SCHEMBL489490 | 0.88 | ATM (0.70) | ATMCYP3A4APPCTSSCTSK | |
| SCHEMBL489489 | 0.88 | ATM (0.70) | ATMCYP3A4APPCTSSCTSK | |
| SCHEMBL7639933 | 0.87 | ATM (0.50) | ATMCYP3A4CYP17A1APPCTSS | |
| SCHEMBL4897776 | 0.86 | ATM (0.54) | ATMCYP3A4CYP17A1APPCTSS | |
| SCHEMBL4899353 | 0.86 | ATM (0.54) | ATMCYP3A4CYP17A1APPCTSS | |
| SCHEMBL7897952 | 0.85 | ATM (0.56) | ATMCYP3A4APPCTSSCTSK | |
| SCHEMBL29163523 | 0.85 | ATM (0.56) | ATMAPPCTSSCTSKCTSL | |
| SCHEMBL28132845 | 0.85 | ATM (0.60) | ATMAPPCTSSCTSKCTSL |
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 |
|---|---|---|---|---|---|---|---|
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |
| WO-2010111634-A2 | RENIN INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2010-09-30 | — | — | WO | disclosed |