Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 8/20 | 0.55 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.53 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | RARA | P10276 | 2/20 | 0.47 |
| ▸ | RARG | P13631 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3601077 | 0.98 | RARB (0.56) | RARBMAOBFFAR1FFAR4ALDH1A1 | |
| SCHEMBL8990804 | 0.94 | RARB (0.56) | RARBMAOBALDH1A1MAPTKMT2A | |
| SCHEMBL8990598 | 0.94 | RARB (0.56) | RARBMAOBALDH1A1MAPTKMT2A | |
| SCHEMBL8037699 | 0.92 | RARB (0.58) | RARBMAOBALDH1A1MAPTKMT2A | |
| SCHEMBL1054597 | 0.91 | FFAR1 (0.59) | FFAR1FFAR4ALDH1A1MAPTKMT2A | |
| SCHEMBL10929094 | 0.90 | HSD17B10 (0.61) | RARBMAOBALDH1A1MAPTKMT2A | |
| SCHEMBL8052463 | 0.90 | HSD17B10 (0.61) | RARBMAOBALDH1A1MAPTKMT2A | |
| SCHEMBL8052476 | 0.90 | HSD17B10 (0.61) | RARBMAOBALDH1A1MAPTKMT2A | |
| Ethane SCHEMBL28237426 | 0.89 | FFAR1 (0.57) | FFAR1FFAR4ALDH1A1MAPTKMT2A | |
| SCHEMBL28900119 | 0.89 | RARB (0.64) | RARBALDH1A1MAPTKMT2ATSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5496499-A | Biphenylethanes and liquid-crystalline phase | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-03-05 | — | — | US | disclosed |
| EP-0429558-B1 | DIPHENYLYLETHANES AND LIQUID CRYSTALLINE PHASE | MERCK PATENT GMBH (DE) | 1994-03-30 | — | — | EP | disclosed |
| WO-1990008757-A1 | DIPHENYLYLETHANES AND LIQUID CRYSTALLINE PHASE | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1990-08-09 | — | — | WO | disclosed |