Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MGAM | O43451 | 1/20 | 0.36 |
| ▸ | SI | P14410 | 1/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CYP4F2 | P78329 | 4/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 4/20 | 0.33 |
| ▸ | PKM | P14618 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 3/20 | 0.32 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9438339 | 0.89 | ALDH1A1 (0.46) | TRPA1ALDH1A1CYP1A2GAAMGAM | |
| SCHEMBL9438259 | 0.88 | ALDH1A1 (0.45) | TRPA1ALDH1A1CYP1A2GAAMGAM | |
| SCHEMBL6740413 | 0.87 | TSHR (0.36) | ALDH1A1CYP1A2GAAMEN1KMT2A | |
| SCHEMBL17626380 | 0.84 | TRPA1 (0.42) | TRPA1ALDH1A1CYP1A2GAAMGAM | |
| SCHEMBL6738109 | 0.83 | GAA (0.39) | TRPA1ALDH1A1CYP1A2GAAMGAM | |
| SCHEMBL9854290 | 0.83 | TRPA1 (0.41) | TRPA1ALDH1A1CYP1A2GAAMGAM | |
| SCHEMBL9854447 | 0.83 | TRPA1 (0.41) | TRPA1ALDH1A1CYP1A2GAAMGAM | |
| SCHEMBL9438171 | 0.82 | CYP1A2 (0.48) | TRPA1ALDH1A1CYP1A2GAAMGAM | |
| SCHEMBL27186828 | 0.82 | ALDH1A1 (0.43) | ALDH1A1GAAMGAMSIMGAM2 | |
| SCHEMBL8166839 | 0.80 | ALDH1A1 (0.42) | ALDH1A1GAAMGAMSIMGAM2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6689917-B2 | Process for the preparation of perfluoroalkanones | DAIKIN INDUSTRIES, LTD. (JP) | 2004-02-10 | — | — | US | disclosed |
| US-20030144557-A1 | Process for the preparation of perfluoroalkanones | DAIKIN INDUSTRIES, LTD. (JP) | 2003-07-31 | — | — | US | disclosed |