Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NAAA | Q02083 | 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 | |
|---|---|---|---|---|
| SCHEMBL10690010 | 1.00 | ALDH1A1 (0.34) | ALDH1A1GRM2HTTKMT2ACYP2C9 | |
| SCHEMBL10690022 | 1.00 | ALDH1A1 (0.34) | ALDH1A1GRM2HTTKMT2ACYP2C9 | |
| SCHEMBL12823921 | 0.85 | CYP2C9 (0.38) | ALDH1A1KMT2ACYP2C9SERPINE1LMNA | |
| SCHEMBL10613792 | 0.84 | ALDH1A1 (0.35) | ALDH1A1GRM2HTTKMT2ACYP2C9 | |
| SCHEMBL10613788 | 0.84 | ALDH1A1 (0.35) | ALDH1A1GRM2HTTKMT2ACYP2C9 | |
| SCHEMBL10613783 | 0.84 | ALDH1A1 (0.35) | ALDH1A1GRM2HTTKMT2ACYP2C9 | |
| SCHEMBL10616019 | 0.83 | ALDH1A1 (0.35) | ALDH1A1GRM2HTTKMT2ACYP2C9 | |
| SCHEMBL10616023 | 0.83 | ALDH1A1 (0.35) | ALDH1A1GRM2HTTKMT2ACYP2C9 | |
| SCHEMBL10616027 | 0.83 | ALDH1A1 (0.35) | ALDH1A1GRM2HTTKMT2ACYP2C9 | |
| SCHEMBL10686736 | 0.82 | ALDH1A1 (0.40) | ALDH1A1GRM2HTTCYP2C9NPC1 |
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 |