Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 5/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | GCGR | P47871 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL20005221 | 0.95 | GRM5 (0.37) | GRM5KCNH2KIF11CA12CA1 | |
| SCHEMBL20004637 | 0.95 | GRM5 (0.37) | GRM5KCNH2KIF11CA12CA1 | |
| SCHEMBL20005246 | 0.88 | ESR1 (0.36) | GRM5KCNH2KIF11CA12CA1 | |
| SCHEMBL20006663 | 0.88 | MEN1 (0.42) | GRM5KCNH2MEN1KMT2AATM | |
| SCHEMBL20004890 | 0.86 | CYP1A2 (0.35) | GRM5KCNH2KIF11CYP2A6MEN1 | |
| SCHEMBL19403026 | 0.86 | GRM5 (0.37) | GRM5KCNH2NFE2L2KIF11CA12 | |
| SCHEMBL20004620 | 0.85 | CYP11B1 (0.31) | — | |
| SCHEMBL26392287 | 0.85 | ALDH1A1 (0.40) | GRM5KCNH2KIF11CA12CA1 | |
| SCHEMBL20006853 | 0.84 | FFAR1 (0.40) | ALDH1A1CYP2A6MEN1KMT2A | |
| SCHEMBL20004904 | 0.83 | ESR1 (0.38) | GRM5KIF11 |
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 |