Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 2/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.30 |
| ▸ | PGR | P06401 | 1/20 | 0.30 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6458041 | 1.00 | TLR4 (0.35) | TLR4MAOAMAOBBACE1FYN | |
| SCHEMBL5685087 | 0.93 | TLR4 (0.30) | TLR4MAOAMAOBBACE1 | |
| SCHEMBL5685082 | 0.93 | TLR4 (0.30) | TLR4MAOAMAOBBACE1 | |
| SCHEMBL8110108 | 0.90 | MAOB (0.36) | TLR4MAOAMAOBFYNNOS1 | |
| SCHEMBL8904980 | 0.90 | MAOB (0.36) | TLR4MAOAMAOBFYNNOS1 | |
| SCHEMBL8110112 | 0.90 | MAOB (0.36) | TLR4MAOAMAOBFYNNOS1 | |
| SCHEMBL6453736 | 0.86 | TLR4 (0.34) | TLR4FYNNOS1 | |
| SCHEMBL7745981 | 0.86 | TLR4 (0.34) | TLR4FYNNOS1 | |
| SCHEMBL6453738 | 0.86 | TLR4 (0.34) | TLR4FYNNOS1 | |
| SCHEMBL6453937 | 0.86 | CYP17A1 (0.38) | TLR4MAOAMAOB |
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 |