Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 4/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.49 |
| ▸ | MMP12 | P39900 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.44 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.43 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.43 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6936303 | 0.90 | RARB (0.49) | RARBMMP2MMP12ALDH1A1HPGD | |
| SCHEMBL6937027 | 0.90 | RARB (0.49) | RARBMMP2MMP12ALDH1A1HPGD | |
| SCHEMBL2835265 | 0.89 | RAB9A (0.44) | RARBMMP2MMP12ALDH1A1HPGD | |
| SCHEMBL2835012 | 0.83 | ALDH1A1 (0.45) | RARBMMP2MMP12ALDH1A1HPGD | |
| SCHEMBL5667645 | 0.80 | ALDH1A1 (0.47) | RARBMMP2MMP12ALDH1A1HPGD | |
| SCHEMBL5669097 | 0.79 | ALDH1A1 (0.46) | MMP2MMP12ALDH1A1HPGDTP53 | |
| SCHEMBL6939565 | 0.78 | HDAC3 (0.43) | RARBMMP2MMP12ALDH1A1 | |
| SCHEMBL6939762 | 0.78 | HDAC3 (0.43) | RARBMMP2MMP12ALDH1A1 | |
| SCHEMBL2233293 | 0.78 | ALDH1A1 (0.43) | MMP2MMP12ALDH1A1HPGDTP53 | |
| SCHEMBL6938314 | 0.77 | KCNH2 (0.42) | MMP2MMP12ALDH1A1HPGDTSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0962445-B1 | Acetylene compound, liquid crystal composition and liquid crystal element | MITSUI CHEMICALS INC (JP) | 2003-02-26 | — | — | EP | disclosed |
| US-6217793-B1 | Acetylene compound, liquid crystal composition and liquid crystal element | MITSUI CHEMICALS, INC. (JP) | 2001-04-17 | — | — | US | disclosed |
| EP-0962445-A1 | Acetylene compound, liquid crystal composition and liquid crystal element | Mitsui Chemicals, Inc. (JP) | 1999-12-08 | — | — | EP | disclosed |