Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1I | Q9P0X4 | 16/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 13/20 | 0.56 |
| ▸ | CACNA1H | O95180 | 4/20 | 0.55 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4272399 | 0.85 | CACNA1I (0.53) | CACNA1IKCNH2CACNA1HCACNA1GPOLB | |
| SCHEMBL26082093 | 0.83 | CACNA1I (0.84) | CACNA1IKCNH2CACNA1HCACNA1GCYP2D6 | |
| SCHEMBL14763517 | 0.83 | CACNA1I (0.67) | CACNA1IKCNH2CACNA1HCACNA1GCYP2D6 | |
| SCHEMBL20056147 | 0.82 | CACNA1I (0.62) | CACNA1IKCNH2CACNA1HCACNA1GCYP2D6 | |
| SCHEMBL4277417 | 0.81 | CACNA1I (0.56) | CACNA1IKCNH2CACNA1HCACNA1GPOLB | |
| SCHEMBL14763239 | 0.79 | CACNA1I (0.56) | CACNA1IKCNH2CACNA1HCACNA1GCYP2D6 | |
| SCHEMBL4280786 | 0.79 | CACNA1I (0.63) | CACNA1IKCNH2CACNA1HCACNA1GCYP2D6 | |
| SCHEMBL4276121 | 0.79 | CACNA1I (0.75) | CACNA1IKCNH2CACNA1HCACNA1GCYP2D6 | |
| SCHEMBL5067690 | 0.78 | KCNH2 (0.51) | CACNA1IKCNH2CACNA1HCACNA1GKMT2A | |
| SCHEMBL4272351 | 0.77 | CACNA1I (0.73) | CACNA1IKCNH2CACNA1HCACNA1GCYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1901746-B1 | 4-FLUORO-PIPERIDINE T-TYPE CALCIUM CHANNEL ANTAGONISTS | MERCK SHARP & DOHME (US) | 2013-02-20 | — | — | EP | disclosed |