Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 13/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 13/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.31 |
| ▸ | KIF11 | P52732 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20006875 | 0.88 | RARB (0.36) | CYP11B1CYP11B2ARCYP1A2MAPT | |
| SCHEMBL20005191 | 0.86 | RARB (0.42) | CYP11B1CYP11B2MAPT | |
| SCHEMBL20004637 | 0.84 | GRM5 (0.37) | CYP11B1CYP11B2CYP1A2MAPTCYP2C19 | |
| SCHEMBL20005221 | 0.84 | GRM5 (0.37) | CYP11B1CYP11B2CYP1A2MAPTCYP2C19 | |
| SCHEMBL20005246 | 0.81 | ESR1 (0.36) | CYP11B1CYP11B2CYP1A2MAPTCYP2C19 | |
| SCHEMBL12011040 | 0.80 | CYP11B1 (0.43) | CYP11B1CYP11B2ARCYP1A2MAPT | |
| SCHEMBL20004620 | 0.80 | CYP11B1 (0.31) | CYP11B1CYP11B2 | |
| SCHEMBL20004633 | 0.80 | ACHE (0.39) | KIF11 | |
| SCHEMBL19999459 | 0.79 | RARB (0.43) | MAPT | |
| SCHEMBL20004890 | 0.79 | CYP1A2 (0.35) | CYP11B1CYP11B2CYP1A2MAPTCYP2C19 |
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-3299439-A1 | LIQUID CRYSTAL COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC Corporation (JP) | 2018-03-28 | — | — | EP | disclosed |