Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 6/20 | 0.50 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 5/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12995421 | 0.81 | TYR (0.44) | TYRCHRNA7ESR1ESR2ALOX5 | |
| SCHEMBL2898583 | 0.81 | TYR (0.50) | TYRCHRNA7ESR1ESR2ALOX5 | |
| SCHEMBL29664506 | 0.81 | TYR (0.50) | TYRCHRNA7ESR1ESR2ALOX5 | |
| SCHEMBL29889998 | 0.81 | TYR (0.44) | TYRCHRNA7ESR1ESR2ALOX5 | |
| SCHEMBL310196 | 0.79 | CHRNA7 (0.50) | TYRCHRNA7ESR1ESR2ALOX5 | |
| SCHEMBL4959085 | 0.79 | TYR (0.48) | TYRCHRNA7ESR1ESR2ALOX5 | |
| SCHEMBL11306662 | 0.79 | TYR (0.48) | TYRCHRNA7ESR1ESR2ALOX5 | |
| SCHEMBL14446348 | 0.79 | TYR (0.48) | TYRCHRNA7ESR1ESR2ALOX5 | |
| SCHEMBL28757491 | 0.79 | CHRNA7 (0.50) | TYRCHRNA7ESR1ESR2ALOX5 | |
| SCHEMBL2767004 | 0.77 | CHRNA7 (0.53) | TYRCHRNA7ESR1ESR2ALOX5 |
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 |