Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.30 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16795880 | 1.00 | CYP2D6 (0.33) | CYP2D6CYP1A2KMT2AAOC3MEN1 | |
| SCHEMBL28364846 | 1.00 | CYP2D6 (0.33) | CYP2D6CYP1A2KMT2AAOC3MEN1 | |
| SCHEMBL15539911 | 1.00 | CYP2D6 (0.33) | CYP2D6CYP1A2KMT2AAOC3MEN1 | |
| SCHEMBL15539824 | 1.00 | CYP2D6 (0.33) | CYP2D6CYP1A2KMT2AAOC3MEN1 | |
| SCHEMBL28884524 | 0.81 | ACP3 (0.41) | CYP2D6CYP1A2LMNAALDH1A1PDK1 | |
| SCHEMBL28364909 | 0.81 | ACP3 (0.41) | CYP2D6CYP1A2LMNAALDH1A1PDK1 | |
| SCHEMBL15539624 | 0.81 | ACP3 (0.41) | CYP2D6CYP1A2LMNAALDH1A1PDK1 | |
| SCHEMBL16795796 | 0.81 | ACP3 (0.41) | CYP2D6CYP1A2LMNAALDH1A1PDK1 | |
| SCHEMBL15538388 | 0.81 | ACP3 (0.41) | CYP2D6CYP1A2LMNAALDH1A1PDK1 | |
| SCHEMBL16795808 | 0.79 | ADRB2 (0.45) | CYP2D6AOC3HIF1AALDH1A1PDK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106507667-B | Sulfamate derivatives for the prevention or treatment of epilepsy | 比皮艾思药物研发有限公司 | 2020-01-24 | — | — | CN | disclosed |