Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | NR3C1 | P04150 | 10/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TSPO | P30536 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14523482 | 0.92 | CYP2C19 (0.42) | CYP2C19NR3C1TSHRCRHR1AOC3 | |
| SCHEMBL14523522 | 0.83 | CYP2C19 (0.40) | CYP2C19NR3C1TSHRCRHR1AOC3 | |
| SCHEMBL1503409 | 0.73 | CYP3A4 (0.48) | TSHRALDH1A1 | |
| SCHEMBL25522770 | 0.73 | ALDH1A1 (0.56) | TSHRALDH1A1 | |
| SCHEMBL13342816 | 0.71 | CYP2C19 (0.42) | CYP2C19NR3C1TSHRCRHR1PGR | |
| SCHEMBL1499891 | 0.69 | TSHR (0.45) | CYP2C19NR3C1TSHRAOC3PGR | |
| SCHEMBL273356 | 0.68 | CYP2C19 (0.46) | CYP2C19NR3C1TSHRCRHR1AOC3 | |
| SCHEMBL18507803 | 0.68 | CYP2C19 (0.46) | CYP2C19NR3C1TSHRCRHR1AOC3 | |
| SCHEMBL14523476 | 0.68 | MAPT (0.33) | CYP2C19ALDH1A1 | |
| SCHEMBL13502119 | 0.68 | CYP2C19 (0.42) | CYP2C19NR3C1TSHRCRHR1AOC3 |
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-2107076-A1 | Conjugated polymer comprising dibenzothiophene- or dibenzofuran-units and their use in polymer LEDs | Sumitomo Chemical Company, Limited (JP) | 2009-10-07 | — | — | EP | disclosed |