Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 3/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | TDP2 | O95551 | 1/20 | 0.30 |
| ▸ | TTR | P02766 | 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 | |
|---|---|---|---|---|
| SCHEMBL15834804 | 0.86 | ALDH1A1 (0.44) | ALDH1A1KIF11FEN1ALOX5APESR1 | |
| SCHEMBL13614387 | 0.85 | ALDH1A1 (0.37) | ALDH1A1KIF11FEN1ALOX5APESR1 | |
| SCHEMBL13412045 | 0.81 | ALDH1A1 (0.39) | ALDH1A1KIF11FEN1ALOX5APESR1 | |
| SCHEMBL13239279 | 0.81 | ALDH1A1 (0.39) | ALDH1A1KIF11FEN1ALOX5APESR1 | |
| SCHEMBL104015 | 0.81 | ALDH1A1 (0.42) | ALDH1A1FEN1ALOX5APESR1ESR2 | |
| SCHEMBL17099320 | 0.80 | TSHR (0.43) | ALDH1A1FEN1ALOX5APESR1HDAC2 | |
| SCHEMBL20967239 | 0.80 | TSHR (0.43) | ALDH1A1FEN1ALOX5APESR1HDAC2 | |
| SCHEMBL503183 | 0.80 | FEN1 (0.44) | FEN1ALOX5APESR1ESR2 | |
| SCHEMBL4567622 | 0.79 | ALDH1A1 (0.37) | ALDH1A1KIF11FEN1ALOX5APESR1 | |
| SCHEMBL13412046 | 0.79 | ALDH1A1 (0.37) | ALDH1A1KIF11FEN1ALOX5APESR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2116522-A1 | PENTACYCLIC LIQUID CRYSTAL COMPOUND HAVING CF<SB>2</SB>O BONDING GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY | Chisso Corporation (JP) | 2009-11-11 | — | — | EP | disclosed |