Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCC9 | O60706 | 1/20 | 0.40 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.40 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.40 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.40 |
| ▸ | RARA | P10276 | 2/20 | 0.40 |
| ▸ | RARB | P10826 | 2/20 | 0.40 |
| ▸ | RARG | P13631 | 2/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.30 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.30 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.30 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9527685 | 0.92 | ABCC9 (0.44) | ABCC9ABCC8KCNJ11KCNJ8RARA | |
| SCHEMBL9525211 | 0.91 | ABCC9 (0.43) | ABCC9ABCC8KCNJ11KCNJ8RARA | |
| SCHEMBL9524903 | 0.84 | ABCC9 (0.42) | ABCC9ABCC8KCNJ11KCNJ8RARA | |
| SCHEMBL9527811 | 0.84 | ABCC9 (0.42) | ABCC9ABCC8KCNJ11KCNJ8ABCB1 | |
| SCHEMBL9527767 | 0.84 | ABCC9 (0.42) | ABCC9ABCC8KCNJ11KCNJ8ABCB1 | |
| Hydrochloric Acid SCHEMBL9627188 | 0.83 | ABCC9 (0.41) | ABCC9ABCC8KCNJ11KCNJ8ABCB1 | |
| SCHEMBL9525765 | 0.81 | ABCC9 (0.46) | ABCC9ABCC8KCNJ11KCNJ8RARA | |
| SCHEMBL6369348 | 0.79 | ABCC9 (0.62) | ABCC9ABCC8KCNJ11KCNJ8ABCB1 | |
| SCHEMBL9527764 | 0.77 | RARA (0.40) | ABCC9RARARARBRARGALDH1A1 | |
| SCHEMBL9523926 | 0.74 | ABCC9 (0.41) | ABCC9ABCC8KCNJ11KCNJ8ABCB1 |
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-0298452-B1 | 2H-1-BENZOPYRANE DERIVATIVES SUBSTITUTED IN POSITION 4 BY ARYL OR N-HETEROARYL | F. HOFFMANN-LA ROCHE AG (CH) | 1993-06-30 | — | — | EP | claimed |
| US-5118694-A | Hypotensive agents; treatment for cardiovascular and muscular disorders | HOFFMANN-LA ROCHE INC. (US) | 1992-06-02 | — | — | US | disclosed |
| US-4971982-A | HYPOTENSIVE AGENTS, CARDIOVASCULAR DISORDERS, SMOOTH MUSCLE DISORDERS | HOFFMANN-LA ROCHE INC. (US) | 1990-11-20 | — | — | US | disclosed |