Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1G | O43497 | 1/20 | 0.38 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.38 |
| ▸ | TACR2 | P21452 | 1/20 | 0.38 |
| ▸ | HTR4 | Q13639 | 9/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | PRKCB | P05771 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | GBA1 | P04062 | 1/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5047955 | 0.80 | CACNA1G (0.39) | CACNA1GCACNA1HTACR2HTR4CYP3A4 | |
| SCHEMBL5051949 | 0.77 | TACR2 (0.37) | CACNA1GCACNA1HTACR2HTR4CYP3A4 | |
| SCHEMBL4272230 | 0.74 | TACR2 (0.42) | CACNA1GCACNA1HTACR2HTR4CYP3A4 | |
| SCHEMBL4275673 | 0.68 | TACR2 (0.46) | TACR2HTR4CYP3A4PRKCBOPRM1 | |
| SCHEMBL4271169 | 0.67 | TACR2 (0.43) | CACNA1GCACNA1HTACR2HTR4CYP3A4 | |
| SCHEMBL8237608 | 0.66 | SIGMAR1 (0.39) | CACNA1GCACNA1HTACR2HTR4CYP3A4 | |
| SCHEMBL5049491 | 0.65 | CACNA2D1 (0.43) | CYP2D6CHRM2OPRM1 | |
| SCHEMBL5053738 | 0.65 | TACR2 (0.38) | TACR2HTR4CYP3A4CYP2D6CHRM2 | |
| SCHEMBL4273009 | 0.64 | TACR2 (0.56) | TACR2 | |
| SCHEMBL3326047 | 0.62 | CACNA1G (0.55) | CACNA1GCACNA1H |
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-1976841-A1 | HETEROCYCLIC AMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | Neuromed Pharmaceuticals, Ltd. (CA) | 2008-10-08 | — | — | EP | claimed |
| WO-2007071035-A1 | HETEROCYCLIC AMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | NEUROMED PHARMACEUTICALS LTD. (CA) | 2007-06-28 | — | — | WO | claimed |