Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1I | Q9P0X4 | 3/20 | 0.53 |
| ▸ | CACNA1H | O95180 | 15/20 | 0.49 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18838406 | 0.94 | CACNA1I (0.60) | CACNA1ICACNA1HCACNA1GCYP2D6KCNH2 | |
| SCHEMBL18838314 | 0.94 | CACNA1I (0.60) | CACNA1ICACNA1HCACNA1GCYP2D6KCNH2 | |
| SCHEMBL18838318 | 0.94 | CACNA1I (0.60) | CACNA1ICACNA1HCACNA1GCYP2D6KCNH2 | |
| SCHEMBL29364770 | 0.94 | CACNA1I (0.60) | CACNA1ICACNA1HCACNA1GCYP2D6KCNH2 | |
| SCHEMBL29364436 | 0.89 | CACNA1H (0.63) | CACNA1ICACNA1HCACNA1GCYP2D6KCNH2 | |
| SCHEMBL18838316 | 0.89 | CACNA1H (0.63) | CACNA1ICACNA1HCACNA1GCYP2D6KCNH2 | |
| SCHEMBL18838322 | 0.89 | CACNA1H (0.63) | CACNA1ICACNA1HCACNA1GCYP2D6KCNH2 | |
| SCHEMBL18838319 | 0.89 | CACNA1H (0.63) | CACNA1ICACNA1HCACNA1GCYP2D6KCNH2 | |
| SCHEMBL18860180 | 0.87 | CACNA1I (0.61) | CACNA1ICACNA1HCACNA1GCYP2D6KCNH2 | |
| SCHEMBL18838359 | 0.87 | CACNA1I (0.61) | CACNA1ICACNA1HCACNA1GCYP2D6KCNH2 |
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-2017083867-A1 | ION CHANNEL INHIBITORY COMPOUNDS, PHARMACEUTICAL FORMULATIONS AND USES | AFASCI, INC. (US) | 2017-05-18 | — | — | WO | disclosed |