Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | PPIB | P23284 | 1/20 | 0.38 |
| ▸ | PPIA | P62937 | 1/20 | 0.38 |
| ▸ | PPID | Q08752 | 1/20 | 0.38 |
| ▸ | PPIG | Q13427 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL13009578 | 1.00 | LMNA (0.40) | LMNACYP1A2CYP3A4MAOAPPIB | |
| SCHEMBL13009593 | 0.92 | DGAT1 (0.42) | LMNACYP1A2CYP3A4MAOAPPIB | |
| SCHEMBL13169131 | 0.92 | DGAT1 (0.42) | LMNACYP1A2CYP3A4MAOAPPIB | |
| SCHEMBL13009584 | 0.92 | DGAT1 (0.42) | LMNACYP1A2CYP3A4MAOAPPIB | |
| SCHEMBL13009581 | 0.88 | ESR2 (0.48) | CYP3A4TDP1KDM4EALDH1A1ESR2 | |
| SCHEMBL1709507 | 0.87 | MEN1 (0.44) | LMNAALDH1A1HTTL3MBTL1FFAR4 | |
| SCHEMBL8587317 | 0.86 | ALDH1A1 (0.47) | LMNAKDM4EALDH1A1HTT | |
| SCHEMBL27942808 | 0.85 | DGAT1 (0.40) | LMNACYP1A2CYP3A4MAOAPPIB | |
| SCHEMBL13008742 | 0.85 | CNR2 (0.45) | LMNACNR2 | |
| SCHEMBL3302331 | 0.84 | DGAT1 (0.48) | LMNACYP1A2CYP3A4MAOAPPIB |
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-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |