Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 12/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 12/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 2/20 | 0.39 |
| ▸ | CTSB | P07858 | 2/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2317 | 0.85 | FFAR1 (0.48) | FFAR1AKR1B1CTSLCTSBCTSK | |
| SCHEMBL14004740 | 0.85 | FFAR1 (0.48) | FFAR1AKR1B1CTSLCTSBCTSK | |
| Hydrochloric Acid SCHEMBL2728 | 0.84 | FFAR1 (0.47) | FFAR1AKR1B1CTSLCTSBCTSK | |
| Hydrochloric Acid SCHEMBL3473569 | 0.84 | FFAR1 (0.47) | FFAR1AKR1B1CTSLCTSBCTSK | |
| SCHEMBL8813467 | 0.84 | FFAR1 (0.44) | PDCD1CD274FFAR1AKR1B1CTSL | |
| SCHEMBL2437416 | 0.79 | CTSS (0.42) | CD274CTSLCTSBCTSKCTSS | |
| SCHEMBL14032424 | 0.78 | FFAR1 (0.47) | FFAR1AKR1B1CTSLCTSBCTSK | |
| SCHEMBL2780 | 0.78 | FFAR1 (0.35) | FFAR1AKR1B1CTSLCTSBCTSK | |
| Hydrochloric Acid SCHEMBL3412065 | 0.78 | CTSB (0.41) | CD274CTSLCTSBCTSKCTSS | |
| SCHEMBL2779 | 0.77 | AGTR1 (0.42) | FFAR1AKR1B1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5965592-A | HYPOTENSIVE AGENTS | NOVARTIS CORPORATION (US) | 1999-10-12 | — | — | US | disclosed |
| US-5399578-A | Hypotensive; valsartan; high blood pressure and cardiac insufficiency | CIBA-GEIGY CORP (US) | 1995-03-21 | — | — | US | disclosed |
| EP-0443983-A1 | Acyl compounds | CIBA-GEIGY AG (CH) | 1991-08-28 | — | — | EP | disclosed |