Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1I | Q9P0X4 | 13/20 | 0.59 |
| ▸ | CACNA1H | O95180 | 8/20 | 0.59 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 11/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13569824 | 0.92 | CACNA1I (0.67) | CACNA1ICACNA1HCACNA1GKCNH2CYP2D6 | |
| SCHEMBL4274756 | 0.91 | CACNA1I (0.61) | CACNA1ICACNA1HCACNA1GKCNH2CYP2D6 | |
| SCHEMBL19113388 | 0.88 | CACNA1I (0.57) | CACNA1ICACNA1HCACNA1GKCNH2CYP2D6 | |
| SCHEMBL13569825 | 0.87 | CACNA1H (0.61) | CACNA1ICACNA1HCACNA1GKCNH2CYP2D6 | |
| SCHEMBL4271126 | 0.84 | CACNA1I (0.69) | CACNA1ICACNA1HCACNA1GKCNH2CYP2D6 | |
| SCHEMBL26082111 | 0.84 | CACNA1I (0.69) | CACNA1ICACNA1HCACNA1GKCNH2CYP2D6 | |
| SCHEMBL26082109 | 0.84 | CACNA1I (0.69) | CACNA1ICACNA1HCACNA1GKCNH2CYP2D6 | |
| SCHEMBL14770274 | 0.82 | CACNA1I (0.61) | CACNA1ICACNA1HCACNA1GKCNH2CYP2D6 | |
| SCHEMBL4274829 | 0.81 | CACNA1I (0.84) | CACNA1ICACNA1HCACNA1GKCNH2CYP2D6 | |
| SCHEMBL4272441 | 0.80 | CACNA1H (0.63) | CACNA1ICACNA1HCACNA1GKCNH2CYP2D6 |
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-2009146540-A1 | N-PIPERIDINYL ACETAMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | NEUROMED PHARMACEUTICALS LTD (CA) | 2009-12-10 | — | — | WO | disclosed |