Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RYR2 | Q92736 | 1/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.37 |
| ▸ | CCR3 | P51677 | 1/20 | 0.37 |
| ▸ | CARM1 | Q86X55 | 2/20 | 0.37 |
| ▸ | PRMT6 | Q96LA8 | 2/20 | 0.37 |
| ▸ | PRMT3 | O60678 | 1/20 | 0.36 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.36 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6867136 | 0.74 | RYR2 (0.76) | RYR2KCNH2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL806929 | 0.74 | RYR2 (1.00) | RYR2KCNH2SIGMAR1 | |
| SCHEMBL8248176 | 0.66 | CCR3 (0.63) | KCNH2TMEM97SIGMAR1CCR3CARM1 | |
| SCHEMBL13309113 | 0.64 | RYR2 (0.68) | RYR2KCNH2SIGMAR1 | |
| SCHEMBL26344969 | 0.64 | RYR2 (0.61) | RYR2KCNH2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL13588754 | 0.63 | CCR3 (0.58) | KCNH2TMEM97SIGMAR1CCR3CARM1 | |
| SCHEMBL7764689 | 0.61 | CCR3 (0.67) | KCNH2SIGMAR1CCR3CARM1PRMT6 | |
| SCHEMBL918100 | 0.60 | CCR3 (0.63) | KCNH2TMEM97SIGMAR1CCR3CARM1 | |
| SCHEMBL360084 | 0.59 | KCNH2 (0.77) | KCNH2TMEM97SIGMAR1CCR3CARM1 | |
| SCHEMBL13229777 | 0.59 | SIGMAR1 (0.74) | KCNH2TMEM97SIGMAR1CCR3CARM1 |
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-2127654-A1 | Benzothiazepine derivatives as ryanodine receptor (RYR2) inhibitors and their use in the treatment of cardiac diseases | The Trustees of Columbia University in the City of New York (US) | 2009-12-02 | — | — | EP | disclosed |