Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 5/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | RARA | P10276 | 1/20 | 0.44 |
| ▸ | RARB | P10826 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.43 |
| ▸ | PDE2A | O00408 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.42 |
| ▸ | FEN1 | P39748 | 1/20 | 0.42 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9222729 | 0.96 | MAPT (0.49) | CYP2D6CYP3A4RARARARBFFAR1 | |
| SCHEMBL9226935 | 0.96 | MAPT (0.49) | CYP2D6CYP3A4RARARARBFFAR1 | |
| SCHEMBL9060955 | 0.96 | MAPT (0.49) | CYP2D6CYP3A4RARARARBFFAR1 | |
| SCHEMBL19792639 | 0.88 | NPC1 (0.42) | FFAR1FFAR4MAPTNPC1RAB9A | |
| SCHEMBL9845134 | 0.87 | PTPN11 (0.50) | RARARARBFFAR1FFAR4MAPT | |
| SCHEMBL9227790 | 0.85 | ALOX5AP (0.39) | RARARARBFFAR1FFAR4MAPT | |
| SCHEMBL9227784 | 0.85 | ALOX5AP (0.39) | RARARARBFFAR1FFAR4MAPT | |
| SCHEMBL9224119 | 0.84 | FAAH (0.48) | CYP2D6CYP3A4RARARARBFFAR1 | |
| SCHEMBL9247693 | 0.83 | PTPN11 (0.54) | CYP2D6CYP3A4RARBFFAR1FFAR4 | |
| SCHEMBL9244788 | 0.83 | PTPN11 (0.54) | CYP2D6CYP3A4RARBFFAR1FFAR4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0132377-B1 | COMPOUNDS CONTAINING A FLUOROBIPHENYLYL GROUP AND THEIR USE IN LIQUID CRYSTAL MATERIALS AND DEVICE | The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) | 1988-06-29 | — | — | EP | disclosed |
| US-4696549-A | Compounds containing a fluorobiphenylyl group and their use in liquid crystal material and devices | THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) | 1987-09-29 | — | — | US | disclosed |
| US-4594465-A | Compounds containing a fluorobiphenylyl group | THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) | 1986-06-10 | — | — | US | disclosed |
| EP-0132377-A2 | Compounds containing a fluorobiphenylyl group and their use in liquid crystal materials and device | The Secretary of State for Defence in Her Britannic Majesty's Government of the United Kingdom of Great Britain and (GB) | 1985-01-30 | — | — | EP | disclosed |