Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.32 |
| ▸ | BACE1 | P56817 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | DPP4 | P27487 | 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 | |
|---|---|---|---|---|
| SCHEMBL9496088 | 1.00 | FFAR1 (0.35) | FFAR1CYP1A2P2RY6FFAR4BACE1 | |
| SCHEMBL9497431 | 0.96 | FFAR1 (0.35) | FFAR1P2RY6FFAR4BACE1 | |
| SCHEMBL9497441 | 0.96 | FFAR1 (0.35) | FFAR1P2RY6FFAR4BACE1 | |
| SCHEMBL9498673 | 0.95 | FFAR1 (0.34) | FFAR1P2RY6FFAR4 | |
| SCHEMBL9498659 | 0.95 | FFAR1 (0.34) | FFAR1P2RY6FFAR4 | |
| SCHEMBL9496300 | 0.95 | FFAR1 (0.34) | FFAR1P2RY6FFAR4 | |
| SCHEMBL9496293 | 0.95 | FFAR1 (0.34) | FFAR1P2RY6FFAR4 | |
| SCHEMBL9495558 | 0.92 | FFAR1 (0.37) | FFAR1P2RY6FFAR4BACE1LMNA | |
| SCHEMBL9495564 | 0.92 | FFAR1 (0.37) | FFAR1P2RY6FFAR4BACE1LMNA | |
| SCHEMBL9495580 | 0.89 | LSS (0.37) | FFAR1CYP1A2P2RY6BACE1DPP4 |
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-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 |
| EP-0306505-A1 | ACETYLENE DERIVATIVES AS COMPONENTS OF LIQUID CRYSTAL PHASES. | MERCK PATENT GMBH (DE) | 1989-03-15 | — | — | EP | disclosed |
| WO-1988007523-A1 | ACETYLENE DERIVATIVES AS COMPONENTS OF LIQUID CRYSTAL PHASES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1988-10-06 | — | — | WO | disclosed |