Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.42 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | SCN1A | P35498 | 1/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.41 |
| ▸ | BDKRB1 | P46663 | 3/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.39 |
| ▸ | MME | P08473 | 3/20 | 0.38 |
| ▸ | MMEL1 | Q495T6 | 1/20 | 0.38 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.38 |
| ▸ | RPS6KA4 | O75676 | 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 | |
|---|---|---|---|---|
| SCHEMBL3035 | 0.93 | SLC6A4 (0.47) | ADRB3PDCD1CD274BACE1SCN1A | |
| SCHEMBL2721 | 0.85 | BDKRB1 (0.39) | ADRB3PDCD1CD274SCN1ASCN2A | |
| SCHEMBL2970 | 0.85 | BDKRB1 (0.39) | ADRB3PDCD1CD274SCN1ASCN2A | |
| SCHEMBL3020 | 0.83 | SCN1A (0.42) | ADRB3PDCD1CD274BACE1SCN1A | |
| SCHEMBL2126 | 0.80 | SCN1A (0.48) | SCN1ASCN2ASCN3ABDKRB1LTB4R2 | |
| SCHEMBL1639 | 0.80 | SLC6A4 (0.48) | PDCD1CD274SCN1ASCN2ASCN3A | |
| SCHEMBL3201 | 0.78 | SCN1A (0.49) | SCN1ASCN2ASCN3ABDKRB1LTB4R2 | |
| SCHEMBL3036 | 0.77 | SLC6A4 (0.46) | PDCD1CD274SCN1ASCN2ASCN3A | |
| SCHEMBL2301 | 0.75 | SCN1A (0.47) | SCN1ASCN2ASCN3AMAPK1 | |
| SCHEMBL28653629 | 0.73 | SIGMAR1 (0.51) | BACE1MAPK1CYP3A4ROCK2ROCK1 |
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 |