Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 3/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | PPARA | Q07869 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7731930 | 0.97 | S1PR1 (0.34) | HDAC3HDAC1HDAC2S1PR1S1PR3 | |
| SCHEMBL7734772 | 0.96 | HTR2A (0.37) | HDAC3HDAC1HDAC2PPARGALOX5 | |
| SCHEMBL7722732 | 0.94 | DAO (0.36) | HDAC3HDAC1HDAC2S1PR1S1PR3 | |
| SCHEMBL7729958 | 0.94 | HTR2A (0.39) | SLC6A4SLC6A3ALDH1A1LMNA | |
| SCHEMBL7731615 | 0.92 | TSHR (0.35) | HDAC3HDAC1HDAC2TSHRDAO | |
| SCHEMBL7731928 | 0.92 | RARB (0.39) | HDAC3HDAC1HDAC2S1PR1PPARG | |
| SCHEMBL7730151 | 0.91 | PCSK9 (0.33) | HDAC3HDAC1HDAC2S1PR1S1PR3 | |
| SCHEMBL7732500 | 0.91 | HDAC3 (0.33) | HDAC3HDAC1HDAC2PCSK9PPARA | |
| SCHEMBL7732528 | 0.90 | HTR2A (0.36) | HDAC3HDAC1HDAC2S1PR1PPARG | |
| SCHEMBL7734998 | 0.90 | TAAR1 (0.33) | ALOX5TSHRDAOSLC6A4SLC6A3 |
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-0786445-B1 | DIFLUOROXYMETHANE DERIVATIVE AND LIQUID CRYSTAL COMPOSITION | CHISSO CORP (JP) | 2002-07-17 | — | — | EP | disclosed |