Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.38 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LIPE | Q05469 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1704591 | 0.88 | CHRM2 (0.37) | ALDH1A1CYP2D6SIGMAR1KDM4E | |
| SCHEMBL377425 | 0.84 | RAB9A (0.40) | SMN1; SMN2ALDH1A1LMNAMAPTFAAH | |
| SCHEMBL377693 | 0.84 | RAB9A (0.40) | SMN1; SMN2ALDH1A1LMNAMAPTFAAH | |
| SCHEMBL377823 | 0.83 | LMNA (0.44) | SMN1; SMN2ALDH1A1SIGMAR1LMNAKDM4E | |
| SCHEMBL377467 | 0.83 | LMNA (0.44) | SMN1; SMN2ALDH1A1SIGMAR1LMNAKDM4E | |
| SCHEMBL3565835 | 0.82 | RAB9A (0.41) | SMN1; SMN2ALDH1A1SIGMAR1LMNAMAPT | |
| SCHEMBL377528 | 0.81 | KDM4E (0.53) | SMN1; SMN2ALDH1A1LMNAMAPTKDM4E | |
| SCHEMBL377869 | 0.81 | KDM4E (0.53) | SMN1; SMN2ALDH1A1LMNAMAPTKDM4E | |
| SCHEMBL1703908 | 0.80 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1CYP2D6SIGMAR1LMNA | |
| SCHEMBL1632683 | 0.75 | KDM4E (0.48) | SMN1; SMN2ALDH1A1SIGMAR1FAAHKDM4E |
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-2441763-A1 | Benzylpiperazine derivatives useful for the treatment of gastrointestinal disorders | Glaxo Group Limited (GB) | 2012-04-18 | — | — | EP | disclosed |