Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.30 |
| ▸ | HTR1A | P08908 | 2/20 | 0.30 |
| ▸ | DRD2 | P14416 | 1/20 | 0.30 |
| ▸ | DRD4 | P21917 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL12734123 | 0.88 | NPC1 (0.34) | NFE2L2 | |
| SCHEMBL10301824 | 0.86 | NFE2L2 (0.36) | NFE2L2SLC6A2SLC6A4SLC6A3HTR1A | |
| SCHEMBL10301825 | 0.86 | — | — | |
| SCHEMBL12889162 | 0.86 | DRD4 (0.30) | DRD4 | |
| SCHEMBL10301828 | 0.84 | — | — | |
| SCHEMBL12716624 | 0.84 | PSMB5 (0.32) | SLC6A2SLC6A4SLC6A3HTR1A | |
| SCHEMBL12734135 | 0.83 | OPRL1 (0.35) | — | |
| SCHEMBL10301841 | 0.83 | HPGD (0.32) | — | |
| SCHEMBL12734011 | 0.82 | PSMB5 (0.33) | — | |
| SCHEMBL12738954 | 0.82 | PSMB5 (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009125668-A1 | TRICYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | チッソ株式会社 (JP) | 2009-10-15 | — | — | WO | disclosed |