Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.34 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.34 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.34 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.34 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.34 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL10033123 | 0.89 | PSEN1 (0.41) | HDAC4DGAT1HRH3PSEN1PSEN2 | |
| SCHEMBL10032999 | 0.74 | SCN9A (0.43) | CHRM4LIPE | |
| SCHEMBL10033002 | 0.72 | SLC6A2 (0.37) | SLC6A2SLC6A4KCNH2TACR1ALDH1A1 | |
| SCHEMBL1709388 | 0.68 | MAOA (0.45) | HDAC4HRH3KCNH2TACR1KDM1A | |
| SCHEMBL27403931 | 0.67 | HRH3 (0.48) | HDAC4DGAT1HRH3PSEN1PSEN2 | |
| SCHEMBL2316015 | 0.66 | PSEN1 (0.43) | DGAT1HRH3PSEN1PSEN2APH1B | |
| SCHEMBL1709467 | 0.66 | TACR1 (0.41) | SLC6A2SLC6A4KCNH2TACR1MEN1 | |
| SCHEMBL10033174 | 0.65 | CFTR (0.41) | SLC6A4TACR1MEN1ALDH1A1KMT2A | |
| SCHEMBL1709405 | 0.64 | TACR1 (0.38) | DGAT1PSEN1PSEN2APH1BNCSTN | |
| SCHEMBL20516506 | 0.64 | HCRTR1 (0.48) | — |
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 |