Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.35 |
| ▸ | PDE4A | P27815 | 5/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 5/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.33 |
| ▸ | BACE1 | P56817 | 2/20 | 0.31 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.31 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6459662 | 1.00 | HCRTR1 (0.35) | HCRTR1HCRTR2PDE4APDE4BPDE4C | |
| SCHEMBL6458497 | 0.87 | KDM1A (0.40) | — | |
| SCHEMBL6458489 | 0.87 | KDM1A (0.40) | — | |
| SCHEMBL6458368 | 0.84 | TLR4 (0.30) | — | |
| SCHEMBL6458363 | 0.84 | TLR4 (0.30) | — | |
| SCHEMBL6452126 | 0.84 | HCRTR1 (0.39) | HCRTR1HCRTR2 | |
| SCHEMBL6452121 | 0.84 | HCRTR1 (0.39) | HCRTR1HCRTR2 | |
| SCHEMBL8767319 | 0.83 | PDE4A (0.38) | HCRTR1HCRTR2PDE4APDE4BPDE4C | |
| SCHEMBL6459659 | 0.83 | KDM1A (0.36) | PDE4APDE4BPDE4CPDE4DSLC6A2 | |
| SCHEMBL6459654 | 0.83 | KDM1A (0.36) | PDE4APDE4BPDE4CPDE4DSLC6A2 |
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-6913797-B1 | Decahydronaphthalene derivative | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2005-07-05 | — | — | US | disclosed |
| EP-1108700-A1 | DECAHYDRONAPHTHALENE DERIVATIVE | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2001-06-20 | — | — | EP | disclosed |