Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 18/20 | 0.81 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL16498680 | 1.00 | CACNA1B (0.81) | CACNA1BGAAKCNH2 | |
| SCHEMBL66748 | 1.00 | CACNA1B (0.81) | CACNA1BGAAKCNH2 | |
| SCHEMBL65962 | 1.00 | CACNA1B (0.81) | CACNA1BGAAKCNH2 | |
| SCHEMBL66758 | 0.91 | CACNA1B (0.83) | CACNA1BGAAKCNH2 | |
| SCHEMBL66453 | 0.90 | CACNA1B (1.00) | CACNA1BGAAKCNH2 | |
| SCHEMBL2419596 | 0.90 | CACNA1B (1.00) | CACNA1BGAAKCNH2 | |
| SCHEMBL16498044 | 0.89 | CACNA1B (0.85) | CACNA1BGAAKCNH2 | |
| SCHEMBL2421678 | 0.89 | CACNA1B (0.85) | CACNA1BGAAKCNH2 | |
| SCHEMBL65323 | 0.89 | CACNA1B (0.85) | CACNA1BGAAKCNH2 | |
| SCHEMBL66593 | 0.89 | CACNA1B (0.85) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2367790-A2 | SUBSTITUTED OCTAHYDROCYCLOPENTA(C)PYRROL-4-AMINES AS CALCIUM CHANNEL BLOCKERS | Abbott Laboratories (US) | 2011-09-28 | — | — | EP | claimed |
| WO-2011149995-A1 | NOVEL SUBSTITUTED OCTAHYDROCYCLOPENTA [C]PYRROL-4-AMINES AS CALCIUM CHANNEL BLOCKERS | ABBOTT LABORATORIES (US) | 2011-12-01 | — | — | WO | disclosed |