Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | HTR4 | Q13639 | 9/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.34 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.34 |
| ▸ | CACNB1 | Q02641 | 2/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5053752 | 0.77 | GRM5 (0.38) | TACR2CHRM4CHRM2HTR4CYP2D6 | |
| SCHEMBL5053738 | 0.77 | TACR2 (0.38) | TACR2CHRM4CHRM2HTR4CYP2D6 | |
| SCHEMBL5133014 | 0.76 | TACR2 (0.37) | TACR2CHRM4CHRM2HTR4CYP2D6 | |
| SCHEMBL4271731 | 0.69 | TACR2 (0.56) | TACR2CACNA2D1CACNA1BCACNB1CCR1 | |
| SCHEMBL375228 | 0.66 | GAA (0.46) | CYP3A4 | |
| SCHEMBL8231635 | 0.63 | SIGMAR1 (0.58) | TACR2ACHE | |
| SCHEMBL4279734 | 0.63 | TACR2 (0.60) | TACR2CYP2D6CYP3A4ACHECACNA2D1 | |
| SCHEMBL15757380 | 0.62 | HTR2B (0.51) | TACR2ACHE | |
| SCHEMBL4273009 | 0.62 | TACR2 (0.56) | TACR2CACNA2D1CACNA1BCACNB1CACNA1C | |
| SCHEMBL28572642 | 0.61 | KDM1A (0.41) | CYP2D6ACHE |
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 |