Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.39 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MME | P08473 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.38 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.37 |
| ▸ | CTSA | P10619 | 2/20 | 0.36 |
| ▸ | OXTR | P30559 | 2/20 | 0.36 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2104 | 0.80 | NLRP3 (0.43) | NLRP3ESR2GRIA2GRIA4ALDH1A1 | |
| SCHEMBL1939 | 0.78 | LTB4R2 (0.52) | MMEFFAR1AKR1B1 | |
| SCHEMBL2686 | 0.77 | ESR2 (0.40) | NLRP3ESR2GRIA2GRIA4ALDH1A1 | |
| SCHEMBL2603 | 0.77 | MYC (0.46) | NLRP3ESR2GRIA2GRIA4ALDH1A1 | |
| SCHEMBL1628 | 0.73 | ESR2 (0.43) | ESR2GRIA2GRIA4ALDH1A1GAA | |
| SCHEMBL29024296 | 0.72 | ALDH1A1 (0.46) | ESR2ALDH1A1GAAL3MBTL1MAPT | |
| SCHEMBL30443795 | 0.72 | ALDH1A1 (0.46) | ESR2ALDH1A1GAAL3MBTL1MAPT | |
| SCHEMBL1892549 | 0.72 | MME (0.50) | NLRP3ESR2GRIA2GRIA4ALDH1A1 | |
| SCHEMBL2934 | 0.71 | GPR119 (0.43) | ESR2GRIA2GRIA4ALDH1A1GAA | |
| SCHEMBL7270546 | 0.71 | ESR2 (0.46) | ESR2GRIA2GRIA4ALDH1A1MME |
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 4 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 |
| 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 |