Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | SLC18A3 | Q16572 | 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 | |
|---|---|---|---|---|
| SCHEMBL21180883 | 0.84 | CES2 (0.43) | ALDH1A1HSD11B1CES2CES1 | |
| SCHEMBL21539010 | 0.72 | CES2 (0.47) | ALDH1A1HSD11B1CES2CES1 | |
| SCHEMBL434235 | 0.71 | — | — | |
| SCHEMBL28242489 | 0.71 | ALDH1A1 (0.80) | ALDH1A1HSD11B1CES2CES1SLC18A3 | |
| SCHEMBL18857303 | 0.71 | ALDH1A1 (0.80) | ALDH1A1HSD11B1CES2CES1SLC18A3 | |
| SCHEMBL672636 | 0.71 | ALDH1A1 (0.80) | ALDH1A1HSD11B1CES2CES1SLC18A3 | |
| SCHEMBL9141553 | 0.71 | ALDH1A1 (0.80) | ALDH1A1HSD11B1CES2CES1SLC18A3 | |
| SCHEMBL136384 | 0.71 | — | — | |
| SCHEMBL16878797 | 0.71 | ALDH1A1 (0.80) | ALDH1A1HSD11B1CES2CES1SLC18A3 | |
| SCHEMBL26184557 | 0.71 | ALDH1A1 (0.80) | ALDH1A1HSD11B1CES2CES1SLC18A3 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000080366-A | LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL OPTICAL ELEMENT | SEIMI CHEM CO LTD | 2000-03-21 | — | — | JP | disclosed |