Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 6/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.51 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.51 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.51 |
| ▸ | HRH1 | P35367 | 1/20 | 0.51 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.51 |
| ▸ | DRD3 | P35462 | 1/20 | 0.51 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11136755 | 1.00 | TBXAS1 (0.54) | TBXAS1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL11136834 | 0.88 | TBXAS1 (0.51) | TBXAS1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL11136860 | 0.88 | TBXAS1 (0.51) | TBXAS1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL8699446 | 0.87 | TBXAS1 (0.68) | TBXAS1TBXA2R | |
| SCHEMBL8699447 | 0.87 | TBXAS1 (0.68) | TBXAS1TBXA2R | |
| SCHEMBL11281216 | 0.84 | CYP3A4 (0.70) | TBXAS1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL11281219 | 0.84 | CYP3A4 (0.70) | TBXAS1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL11143864 | 0.82 | CYP3A4 (0.76) | CYP1A2CYP3A4CYP2D6CYP2C9ALOX15 | |
| SCHEMBL11143903 | 0.82 | CYP3A4 (0.50) | TBXAS1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL11143907 | 0.82 | CYP3A4 (0.50) | TBXAS1CYP1A2CYP3A4CYP2D6CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4418065-A | ANTIDEPRESSANTS | ASTRA LAKEMEDEL AKTIEBOLAG (SE) | 1983-11-29 | — | — | US | disclosed |
| EP-0081478-A2 | Novel halophenyl-pyridyl-allylamine derivatives, processes and intermediates as well as pharmaceutical preparations thereof | Astra Läkemedel Aktiebolag (SE) | 1983-06-15 | — | — | EP | disclosed |