Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 7/20 | 0.58 |
| ▸ | HCAR3 | P49019 | 5/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | RARA | P10276 | 1/20 | 0.54 |
| ▸ | MTOR | P42345 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.52 |
| ▸ | RELA | Q04206 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10660563 | 1.00 | RARB (0.58) | RARBHCAR3MAPTMEN1ALDH1A1 | |
| SCHEMBL10661712 | 1.00 | RARB (0.58) | RARBHCAR3MAPTMEN1ALDH1A1 | |
| SCHEMBL10658847 | 1.00 | RARB (0.58) | RARBHCAR3MAPTMEN1ALDH1A1 | |
| SCHEMBL10663476 | 0.98 | HCAR3 (0.57) | RARBHCAR3MAPTMEN1ALDH1A1 | |
| SCHEMBL10663641 | 0.93 | HCAR3 (0.56) | RARBHCAR3MAPTMEN1ALDH1A1 | |
| SCHEMBL13606277 | 0.90 | TP53 (0.52) | RARBHCAR3NPC1NFKB1RAB9A | |
| SCHEMBL8164770 | 0.88 | RARB (0.64) | RARBMAPTMEN1ALDH1A1RARA | |
| SCHEMBL565981 | 0.86 | HCAR3 (0.58) | RARBHCAR3MAPTALDH1A1NPC1 | |
| SCHEMBL8229222 | 0.85 | P4HA1 (0.47) | RARBHCAR3MAPTALDH1A1 | |
| SCHEMBL30432120 | 0.85 | P4HA1 (0.47) | RARBHCAR3MAPTALDH1A1 |
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-0258430-A1 | NEMATIC LIQUID CRYSTAL PHASES | MERCK PATENT GmbH (DE) | 1988-03-09 | — | — | EP | disclosed |
| WO-1987005316-A1 | NEMATIC LIQUID CRYSTAL PHASES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1987-09-11 | — | — | WO | disclosed |