Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 6/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TRPV4 | Q9HBA0 | 3/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | ACR | P10323 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6452321 | 1.00 | ACHE (0.35) | ACHEALDH1A1HPGDTRPV4PRSS1 | |
| SCHEMBL6454230 | 1.00 | ACHE (0.35) | ACHEALDH1A1HPGDTRPV4PRSS1 | |
| SCHEMBL6454226 | 1.00 | ACHE (0.35) | ACHEALDH1A1HPGDTRPV4PRSS1 | |
| SCHEMBL6454397 | 0.99 | ACHE (0.34) | ACHEALDH1A1HPGDTRPV4PRSS1 | |
| SCHEMBL6454401 | 0.99 | ACHE (0.34) | ACHEALDH1A1HPGDTRPV4PRSS1 | |
| SCHEMBL6464701 | 0.97 | ACHE (0.33) | ACHEALDH1A1HPGDTRPV4PRSS1 | |
| SCHEMBL6464704 | 0.97 | ACHE (0.33) | ACHEALDH1A1HPGDTRPV4PRSS1 | |
| SCHEMBL6450728 | 0.93 | TRPV4 (0.33) | ACHEALDH1A1TRPV4 | |
| SCHEMBL6450732 | 0.93 | TRPV4 (0.33) | ACHEALDH1A1TRPV4 | |
| SCHEMBL6459524 | 0.90 | MGLL (0.39) | ACHE |
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 |