Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 6/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.38 |
| ▸ | RARA | P10276 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6459117 | 1.00 | CYP2C9 (0.47) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL6454612 | 0.99 | CYP2C9 (0.46) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL6461439 | 0.99 | CYP2C9 (0.46) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL6461442 | 0.99 | CYP2C9 (0.46) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL6454611 | 0.99 | CYP2C9 (0.46) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL6453874 | 0.96 | CYP2C9 (0.48) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL6453878 | 0.96 | CYP2C9 (0.48) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL6457428 | 0.91 | CYP2C9 (0.57) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL6457433 | 0.91 | CYP2C9 (0.57) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL10910850 | 0.88 | CYP2C9 (0.57) | CYP2C9ALDH1A1MAPTLMNAMEN1 |
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 |