Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 7/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.41 |
| ▸ | RARB | P10826 | 5/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.40 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | RARA | P10276 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10690485 | 1.00 | ALDH1A1 (0.46) | ALDH1A1LTA4HCHRM2CHRM3CHRM4 | |
| SCHEMBL10690476 | 1.00 | ALDH1A1 (0.46) | ALDH1A1LTA4HCHRM2CHRM3CHRM4 | |
| SCHEMBL10685709 | 0.90 | ALDH1A1 (0.46) | ALDH1A1LTA4HCHRM2CHRM3CHRM4 | |
| SCHEMBL10686861 | 0.88 | ALDH1A1 (0.45) | ALDH1A1LTA4HCHRM2CHRM3CHRM4 | |
| SCHEMBL10686867 | 0.88 | ALDH1A1 (0.45) | ALDH1A1LTA4HCHRM2CHRM3CHRM4 | |
| SCHEMBL10686854 | 0.88 | ALDH1A1 (0.45) | ALDH1A1LTA4HCHRM2CHRM3CHRM4 | |
| SCHEMBL10687952 | 0.83 | ALDH1A1 (0.51) | ALDH1A1CHRM2CHRM3CHRM4CHRM1 | |
| SCHEMBL10687946 | 0.83 | ALDH1A1 (0.51) | ALDH1A1CHRM2CHRM3CHRM4CHRM1 | |
| SCHEMBL10690522 | 0.83 | CHRM2 (0.57) | ALDH1A1CHRM2CHRM3CHRM4CHRM1 | |
| SCHEMBL10690533 | 0.83 | CHRM2 (0.57) | ALDH1A1CHRM2CHRM3CHRM4CHRM1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4755323-A | Mixture of liquid crystalline compounds including substituted para-dioxane | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-07-05 | — | — | US | disclosed |