Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN1A | P35498 | 2/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.42 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.42 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.41 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | BDKRB1 | P46663 | 4/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.38 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.38 |
| ▸ | PRKACA | P17612 | 1/20 | 0.38 |
| ▸ | GSK3A | P49840 | 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 | |
|---|---|---|---|---|
| SCHEMBL3036 | 0.93 | SLC6A4 (0.46) | SCN1ASCN2ASCN3APDCD1CD274 | |
| SCHEMBL2722 | 0.85 | BDKRB1 (0.36) | SCN1ASCN2ASCN3APDCD1CD274 | |
| SCHEMBL2971 | 0.85 | BDKRB1 (0.36) | SCN1ASCN2ASCN3APDCD1CD274 | |
| SCHEMBL3019 | 0.83 | ADRB3 (0.42) | SCN1ASCN2ASCN3APDCD1CD274 | |
| SCHEMBL2127 | 0.79 | SCN1A (0.50) | SCN1ASCN2ASCN3ACHRNB2CHRNB4 | |
| SCHEMBL3202 | 0.77 | SCN1A (0.51) | SCN1ASCN2ASCN3ACHRNB2CHRNB4 | |
| SCHEMBL3035 | 0.77 | SLC6A4 (0.47) | SCN1ASCN2ASCN3APDCD1CD274 | |
| SCHEMBL2302 | 0.75 | SCN1A (0.51) | SCN1ASCN2ASCN3ACHRNB2CHRNB4 | |
| SCHEMBL1615 | 0.72 | SCN1A (0.51) | SCN1ASCN2ASCN3ACHRNB2CHRNB4 | |
| SCHEMBL28653631 | 0.72 | SIGMAR1 (0.51) | BACE1ROCK2ROCK1MAPK1RPS6KA5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0443983-B1 | Acyl compounds | CIBA GEIGY AG (CH) | 1996-02-28 | — | — | EP | 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 |