Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 3/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27587412 | 0.94 | HDAC3 (0.47) | TBXAS1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL27985511 | 0.86 | CYP2D6 (0.48) | TBXAS1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL27587441 | 0.86 | CYP2D6 (0.48) | TBXAS1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4063595 | 0.86 | CYP2D6 (0.48) | TBXAS1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL3154532 | 0.82 | TBXAS1 (0.71) | TBXAS1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL7773626 | 0.81 | TBXAS1 (0.73) | TBXAS1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL27585172 | 0.81 | TBXAS1 (0.55) | TBXAS1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL7683666 | 0.81 | TBXAS1 (0.73) | TBXAS1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL27820361 | 0.81 | TBXAS1 (0.55) | TBXAS1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL3146207 | 0.79 | TBXAS1 (0.58) | TBXAS1HDAC3HDAC4HDAC1HDAC7 |
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-0295604-A1 | (E)-2-(p-Fluorophenethyl)-3-fluoroallylamine | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-12-21 | — | — | EP | disclosed |