Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL6568390 | 0.91 | TAAR1 (0.40) | TAAR1SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL6569390 | 0.88 | SCN9A (0.33) | TAAR1SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL6570597 | 0.85 | TAAR1 (0.37) | TAAR1SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL6569451 | 0.84 | PARP1 (0.38) | TAAR1SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL6570589 | 0.80 | CNR2 (0.38) | SLC6A4SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL6569112 | 0.79 | SCN9A (0.34) | TAAR1SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL6567583 | 0.79 | HDAC3 (0.39) | SLC6A4SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL6569071 | 0.78 | PTGS1 (0.36) | CYP2D6NPSR1CYP3A4GAAMAPT | |
| SCHEMBL6569219 | 0.77 | TAAR1 (0.38) | TAAR1SLC6A4SLC6A2SLC6A3CYP2D6 | |
| SCHEMBL6568363 | 0.76 | CALM1 (0.36) | TAAR1MEN1KMT2A |
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-1405851-A1 | Method for producing seven-membered diether compounds and intermediates thereof | Takasago International Corporation (JP) | 2004-04-07 | — | — | EP | disclosed |