Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 17/20 | 0.75 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL66848 | 1.00 | CACNA1B (0.75) | CACNA1BGAAHPGDKCNH2 | |
| SCHEMBL66899 | 1.00 | CACNA1B (0.75) | CACNA1BGAAHPGDKCNH2 | |
| SCHEMBL2849860 | 0.88 | CACNA1B (0.68) | CACNA1BGAAHPGDKCNH2 | |
| SCHEMBL67416 | 0.88 | CACNA1B (0.72) | CACNA1BGAAHPGDKCNH2 | |
| SCHEMBL2844971 | 0.88 | CACNA1B (0.68) | CACNA1BGAAHPGDKCNH2 | |
| SCHEMBL66128 | 0.87 | CACNA1B (0.67) | CACNA1BGAAHPGDKCNH2 | |
| SCHEMBL16497890 | 0.86 | CACNA1B (1.00) | CACNA1BGAAHPGDKCNH2 | |
| SCHEMBL2417881 | 0.86 | CACNA1B (1.00) | CACNA1BGAAHPGDKCNH2 | |
| SCHEMBL67427 | 0.86 | CACNA1B (1.00) | CACNA1BGAAHPGDKCNH2 | |
| SCHEMBL67089 | 0.86 | CACNA1B (1.00) | CACNA1BGAAHPGDKCNH2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8129417-B2 | Substituted octahydrocyclopenta[C]pyrrol-4-amines as calcium channel blockers | ABBOTT LABORATORIES (US) | 2012-03-06 | — | — | US | claimed |