Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 18/20 | 1.00 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2847560 | 0.93 | CACNA1B (0.87) | CACNA1BGAAKCNH2 | |
| SCHEMBL2847030 | 0.93 | CACNA1B (0.87) | CACNA1BGAAKCNH2 | |
| SCHEMBL2847137 | 0.90 | CACNA1B (0.84) | CACNA1BGAAKCNH2 | |
| SCHEMBL2850667 | 0.89 | CACNA1B (0.81) | CACNA1BGAAKCNH2 | |
| SCHEMBL2844699 | 0.89 | CACNA1B (0.81) | CACNA1BGAAKCNH2 | |
| SCHEMBL2419596 | 0.86 | CACNA1B (1.00) | CACNA1BGAAKCNH2 | |
| SCHEMBL66204 | 0.86 | CACNA1B (1.00) | CACNA1BGAAKCNH2 | |
| SCHEMBL65926 | 0.86 | CACNA1B (1.00) | CACNA1BGAAKCNH2 | |
| SCHEMBL65900 | 0.86 | CACNA1B (1.00) | CACNA1BGAAKCNH2 | |
| SCHEMBL66453 | 0.86 | CACNA1B (1.00) | CACNA1BGAAKCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010062927-A2 | NOVEL SUBSTITUTED OCTAHYDROCYCLOPENTA(C)PYRROL-4-AMINES AS CALCIUM CHANNEL BLOCKERS | ABBOTT LABORATORIES (US) | 2010-06-03 | — | — | WO | claimed |