Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.37 |
| ▸ | CA1 | P00915 | 4/20 | 0.37 |
| ▸ | CA9 | Q16790 | 4/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6451247 | 1.00 | CA12 (0.37) | CA12CA1CA9SLC6A4SLC6A2 | |
| SCHEMBL6459549 | 0.94 | CA12 (0.36) | CA12CA1CA9SLC6A4SLC6A2 | |
| SCHEMBL6459542 | 0.94 | CA12 (0.36) | CA12CA1CA9SLC6A4SLC6A2 | |
| SCHEMBL6451905 | 0.93 | CA12 (0.35) | CA12CA1CA9SLC6A4SLC6A2 | |
| SCHEMBL6451901 | 0.93 | CA12 (0.35) | CA12CA1CA9SLC6A4SLC6A2 | |
| SCHEMBL6455369 | 0.92 | CNR1 (0.35) | CA12CA1CA9SLC6A4SLC6A2 | |
| SCHEMBL6455370 | 0.92 | CNR1 (0.35) | CA12CA1CA9SLC6A4SLC6A2 | |
| SCHEMBL6452449 | 0.92 | CNR1 (0.35) | CA12CA1CA9SLC6A4SLC6A2 | |
| SCHEMBL6452452 | 0.92 | CNR1 (0.35) | CA12CA1CA9SLC6A4SLC6A2 | |
| SCHEMBL6454942 | 0.91 | SLC6A2 (0.39) | CA12CA1CA9SLC6A4SLC6A2 |
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 |