Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.54 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11542289 | 0.98 | SIGMAR1 (0.53) | SIGMAR1GRIN2BLTA4HALDH1A1L3MBTL1 | |
| SCHEMBL13297902 | 0.92 | SLC6A3 (0.50) | SIGMAR1SLC6A3HTR6 | |
| SCHEMBL11542316 | 0.90 | SIGMAR1 (0.51) | SIGMAR1SLC6A3HTR6 | |
| SCHEMBL9304524 | 0.87 | SIGMAR1 (0.55) | SIGMAR1HTR6 | |
| SCHEMBL3868123 | 0.81 | HTR6 (0.53) | SIGMAR1ALDH1A1HTR6 | |
| SCHEMBL3874874 | 0.81 | HTR6 (0.53) | SIGMAR1ALDH1A1HTR6 | |
| SCHEMBL11541639 | 0.80 | SIGMAR1 (0.48) | SIGMAR1GRIN2B | |
| SCHEMBL9304462 | 0.78 | CNR1 (0.50) | SIGMAR1 | |
| SCHEMBL31121639 | 0.77 | HTR6 (0.56) | SIGMAR1HTR6 | |
| SCHEMBL2338975 | 0.77 | HTR6 (0.56) | SIGMAR1HTR6 |
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 |
|---|---|---|---|---|---|---|---|
| US-4127578-A | Diene intermediates for indantetrols | E. R. SQUIBB & SONS, INC. (US) | 1978-11-28 | — | — | US | disclosed |
| US-4092318-A | HYPOTENSIVES | E. R. SQUIBB & SONS, INC. (US) | 1978-05-30 | — | — | US | disclosed |
| US-4044040-A | HYPERTENSIVE AGENTS | E. R. SQUIBB & SONS, INC. (US) | 1977-08-23 | — | — | US | disclosed |