Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 7/20 | 0.30 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL6457589 | 1.00 | GAA (0.31) | GAAMAPTDGAT1CNR2SPHK1 | |
| SCHEMBL6453445 | 1.00 | GAA (0.31) | GAAMAPTDGAT1CNR2SPHK1 | |
| SCHEMBL6453449 | 1.00 | GAA (0.31) | GAAMAPTDGAT1CNR2SPHK1 | |
| SCHEMBL6450753 | 0.99 | ESR2 (0.31) | ESR2 | |
| SCHEMBL6450752 | 0.99 | ESR2 (0.31) | ESR2 | |
| SCHEMBL6456609 | 0.96 | ESR2 (0.33) | ESR2 | |
| SCHEMBL6456606 | 0.96 | ESR2 (0.33) | ESR2 | |
| SCHEMBL6457938 | 0.92 | CYP2C9 (0.34) | MAPT | |
| SCHEMBL6457933 | 0.92 | CYP2C9 (0.34) | MAPT | |
| SCHEMBL6461691 | 0.90 | FASN (0.30) | — |
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 |