Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 3/20 | 0.37 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.33 |
| ▸ | HAO1 | Q9UJM8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9496001 | 1.00 | FFAR1 (0.37) | FFAR1P2RY6BACE1FFAR4HAO1 | |
| SCHEMBL9496373 | 0.87 | FFAR1 (0.39) | FFAR1P2RY6BACE1FFAR4 | |
| SCHEMBL9496384 | 0.87 | FFAR1 (0.39) | FFAR1P2RY6BACE1FFAR4 | |
| SCHEMBL9495003 | 0.84 | FFAR1 (0.38) | FFAR1P2RY6BACE1FFAR4 | |
| SCHEMBL9494993 | 0.84 | FFAR1 (0.38) | FFAR1P2RY6BACE1FFAR4 | |
| SCHEMBL9498524 | 0.83 | MEN1 (0.36) | FFAR1P2RY6BACE1FFAR4 | |
| SCHEMBL9498537 | 0.83 | MEN1 (0.36) | FFAR1P2RY6BACE1FFAR4 | |
| SCHEMBL9495558 | 0.82 | FFAR1 (0.37) | FFAR1P2RY6BACE1FFAR4 | |
| SCHEMBL9495564 | 0.82 | FFAR1 (0.37) | FFAR1P2RY6BACE1FFAR4 | |
| SCHEMBL9496097 | 0.80 | FFAR1 (0.35) | FFAR1P2RY6BACE1FFAR4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0306505-B1 | ACETYLENE DERIVATIVES AS COMPONENTS OF LIQUID CRYSTAL PHASES | MERCK PATENT GmbH (DE) | 1993-03-24 | — | — | EP | disclosed |
| US-5068053-A | Liquid crystals for optical apparatus | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-11-26 | — | — | US | disclosed |