Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 14/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9255589 | 1.00 | OPRL1 (0.39) | OPRL1SLC6A2ESR2SLC6A4 | |
| SCHEMBL9255583 | 1.00 | OPRL1 (0.39) | OPRL1SLC6A2ESR2SLC6A4 | |
| SCHEMBL9252786 | 0.96 | OPRL1 (0.37) | OPRL1SLC6A2ESR2SLC6A4 | |
| SCHEMBL9252800 | 0.96 | OPRL1 (0.37) | OPRL1SLC6A2ESR2SLC6A4 | |
| SCHEMBL9252794 | 0.96 | OPRL1 (0.37) | OPRL1SLC6A2ESR2SLC6A4 | |
| SCHEMBL9250468 | 0.89 | OPRL1 (0.41) | OPRL1SLC6A2ESR2SLC6A4 | |
| SCHEMBL9250467 | 0.89 | OPRL1 (0.41) | OPRL1SLC6A2ESR2SLC6A4 | |
| SCHEMBL9250472 | 0.89 | OPRL1 (0.41) | OPRL1SLC6A2ESR2SLC6A4 | |
| SCHEMBL9256616 | 0.87 | OPRL1 (0.40) | OPRL1ESR2 | |
| SCHEMBL9256602 | 0.87 | OPRL1 (0.40) | OPRL1ESR2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5454974-A | Halobenzene liquid crystals | HOFFMANN-LA ROCHE INC. (US) | 1995-10-03 | — | — | US | disclosed |
| US-5302317-A | Halobenzene liquid crystals | HOFFMANN-LA ROCHE INC. (US) | 1994-04-12 | — | — | US | disclosed |
| EP-0315014-B1 | Halogenated benzene derivatives | HOFFMANN LA ROCHE (CH) | 1994-01-12 | — | — | EP | disclosed |
| US-5230826-A | HALOBENZENE LIQUID CRYSTALS | HOFFMANN-LA ROCHE INC. (US) | 1993-07-27 | — | — | US | disclosed |
| US-5013477-A | Alkenylbicyclohexane liquid crystals | HOFFMANN-LA ROCHE INC. (US) | 1991-05-07 | — | — | US | disclosed |