Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 3/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.34 |
| ▸ | TACR1 | P25103 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL8300797 | 0.90 | PDE4A (0.40) | PDE4AOPRM1OPRK1PDE4BPDE4C | |
| SCHEMBL8291779 | 0.71 | SLC6A4 (0.43) | SLC6A3SLC6A2SLC6A4KCNH2 | |
| SCHEMBL8292203 | 0.71 | UTS2R (0.41) | OPRM1OPRK1SLC6A3TACR1SLC6A4 | |
| SCHEMBL8298259 | 0.71 | SLC6A2 (0.36) | OPRM1OPRK1SLC6A3SLC6A2SLC6A4 | |
| SCHEMBL7846543 | 0.69 | TACR1 (0.47) | TACR1 | |
| SCHEMBL8564881 | 0.69 | PDE4A (0.38) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8291783 | 0.69 | SLC6A2 (0.41) | SLC6A3SLC6A2SLC6A4KCNH2 | |
| SCHEMBL8311113 | 0.69 | SLC6A2 (0.44) | PDE4BSLC6A3SLC6A2SLC6A4KCNH2 | |
| SCHEMBL8300632 | 0.68 | SLC6A2 (0.46) | SLC6A3SLC6A2SLC6A4KCNH2 | |
| SCHEMBL8292045 | 0.68 | SLC6A2 (0.38) | SLC6A3SLC6A2SLC6A4KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5807865-A | 3,3-disubstituted piperidine derivatives and their use as therapeutic agents | MERCK SHARP & DOHME LIMITED (GB) | 1998-09-15 | — | — | US | disclosed |