Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 13/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9250472 | 1.00 | OPRL1 (0.41) | OPRL1SLC6A2CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL9250467 | 1.00 | OPRL1 (0.41) | OPRL1SLC6A2CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL9255684 | 0.96 | OPRL1 (0.39) | OPRL1SLC6A2CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL9255696 | 0.96 | OPRL1 (0.39) | OPRL1SLC6A2CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL9255691 | 0.96 | OPRL1 (0.39) | OPRL1SLC6A2CYP2D6SLC6A4SLC6A3 | |
| SCHEMBL9255583 | 0.89 | OPRL1 (0.39) | OPRL1SLC6A2SLC6A4ESR2 | |
| SCHEMBL9255592 | 0.89 | OPRL1 (0.39) | OPRL1SLC6A2SLC6A4ESR2 | |
| SCHEMBL9255589 | 0.89 | OPRL1 (0.39) | OPRL1SLC6A2SLC6A4ESR2 | |
| SCHEMBL9256602 | 0.87 | OPRL1 (0.40) | OPRL1ESR2DGAT1 | |
| SCHEMBL9256609 | 0.87 | OPRL1 (0.40) | OPRL1ESR2DGAT1 |
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 8 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 |
| EP-0315014-B1 | Halogenated benzene derivatives | HOFFMANN LA ROCHE (CH) | 1994-01-12 | — | — | EP | disclosed |
| EP-0315050-B1 | ALCENYL BICYCLOHEXANES | F. HOFFMANN-LA ROCHE AG (CH) | 1993-09-01 | — | — | 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 |
| EP-0331933-A2 | Liquid crystal mixture with a low optical anisotropy | F. HOFFMANN-LA ROCHE AG (CH) | 1989-09-13 | — | — | EP | disclosed |
| EP-0315014-A2 | Halogenated benzene derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1989-05-10 | — | — | EP | disclosed |
| EP-0315050-A2 | Alcenyl bicyclohexanes | F. HOFFMANN-LA ROCHE AG (CH) | 1989-05-10 | — | — | EP | disclosed |