Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 13/20 | 0.40 |
| ▸ | PDE4A | P27815 | 11/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 11/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 11/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 11/20 | 0.40 |
| ▸ | PDE8B | O95263 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31614910 | 0.85 | PDE10A (0.35) | PDE10AALDH1A1 | |
| SCHEMBL20042875 | 0.85 | PDE10A (0.35) | PDE10AALDH1A1 | |
| SCHEMBL31615013 | 0.85 | PDE10A (0.35) | PDE10AALDH1A1 | |
| SCHEMBL31615020 | 0.85 | PDE10A (0.35) | PDE10AALDH1A1 | |
| SCHEMBL20042838 | 0.85 | PDE10A (0.35) | PDE10AALDH1A1 | |
| SCHEMBL20042723 | 0.83 | PDE8B (0.38) | CHRM3PDE8BALDH1A1 | |
| SCHEMBL20042916 | 0.83 | ALDH1A1 (0.36) | PDE10AALDH1A1 | |
| SCHEMBL20042840 | 0.81 | CHRM3 (0.43) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL20042761 | 0.78 | MTOR (0.44) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL31614776 | 0.76 | PDE10A (0.36) | PDE10A |
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-2018066718-A1 | THERAPEUTIC COMPOUNDS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-04-12 | — | — | WO | disclosed |