Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 1/20 | 0.46 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.46 |
| ▸ | MYC | P01106 | 1/20 | 0.45 |
| ▸ | WDR5 | P61964 | 1/20 | 0.45 |
| ▸ | MME | P08473 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.40 |
| ▸ | USP2 | O75604 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2772 | 0.91 | ITGB1 (0.44) | ITGB1ITGA4MYCWDR5MME | |
| SCHEMBL2065 | 0.86 | CA12 (0.50) | ITGB1ITGA4MYCWDR5MME | |
| SCHEMBL2870 | 0.86 | MYC (0.47) | ITGB1ITGA4MYCWDR5MME | |
| SCHEMBL2132 | 0.86 | MYC (0.47) | ITGB1ITGA4MYCWDR5MME | |
| SCHEMBL2465 | 0.85 | MYC (0.43) | ITGB1ITGA4MYCWDR5MME | |
| SCHEMBL3121 | 0.85 | MYC (0.43) | ITGB1ITGA4MYCWDR5MME | |
| SCHEMBL2174 | 0.84 | MYC (0.45) | ITGB1ITGA4MYCWDR5MME | |
| SCHEMBL2432 | 0.84 | MYC (0.45) | ITGB1ITGA4MYCWDR5MME | |
| SCHEMBL8065614 | 0.84 | MYC (0.45) | ITGB1ITGA4MYCWDR5MME | |
| Hydrochloric Acid SCHEMBL3526296 | 0.83 | MYC (0.45) | ITGB1ITGA4MYCWDR5MME |
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-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 |