Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL6463338 | 1.00 | TLR4 (0.33) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL6453769 | 0.94 | CYP2C9 (0.30) | CYP2C9 | |
| SCHEMBL6453765 | 0.94 | CYP2C9 (0.30) | CYP2C9 | |
| SCHEMBL8101051 | 0.93 | CYP2C9 (0.37) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL7510008 | 0.93 | CYP2C9 (0.37) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL8101057 | 0.93 | CYP2C9 (0.37) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL6457479 | 0.86 | TLR4 (0.35) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL6457473 | 0.86 | TLR4 (0.35) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL6458556 | 0.85 | KDM1A (0.35) | TLR4CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL6458552 | 0.85 | KDM1A (0.35) | TLR4CYP2C9ALDH1A1LMNAMAPT |
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 |