Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9855228 | 1.00 | FFAR1 (0.43) | FFAR1CYP1A2FFAR4MAPK1LMNA | |
| SCHEMBL9855901 | 0.95 | FFAR1 (0.42) | FFAR1CYP1A2FFAR4MAPK1LMNA | |
| SCHEMBL9498081 | 0.95 | FFAR1 (0.42) | FFAR1CYP1A2FFAR4MAPK1LMNA | |
| SCHEMBL9496725 | 0.93 | FFAR1 (0.41) | FFAR1CYP1A2FFAR4HTTKMT2A | |
| SCHEMBL9855387 | 0.93 | FFAR1 (0.41) | FFAR1CYP1A2FFAR4HTTKMT2A | |
| SCHEMBL24717467 | 0.92 | FFAR1 (0.38) | FFAR1CYP1A2FFAR4MAPK1LMNA | |
| SCHEMBL9496653 | 0.92 | FFAR1 (0.38) | FFAR1CYP1A2FFAR4MAPK1LMNA | |
| SCHEMBL9498796 | 0.92 | KCNH2 (0.39) | FFAR1CYP1A2FFAR4MAPK1LMNA | |
| SCHEMBL9498804 | 0.92 | KCNH2 (0.39) | FFAR1CYP1A2FFAR4MAPK1LMNA | |
| SCHEMBL9496660 | 0.92 | FFAR1 (0.38) | FFAR1CYP1A2FFAR4MAPK1LMNA |
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 |