Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 8/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TPH1 | P17752 | 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 | |
|---|---|---|---|---|
| SCHEMBL12622794 | 0.91 | OPRL1 (0.31) | OPRL1 | |
| SCHEMBL12622905 | 0.91 | OPRL1 (0.31) | OPRL1 | |
| SCHEMBL12622763 | 0.88 | OPRL1 (0.33) | OPRL1CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL12622874 | 0.88 | OPRL1 (0.33) | OPRL1CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL16326077 | 0.87 | KDM1A (0.30) | KDM1ATPH1 | |
| SCHEMBL19829113 | 0.85 | SCN9A (0.33) | KDM1A | |
| SCHEMBL12622915 | 0.85 | KDM1A (0.36) | OPRL1KDM1A | |
| SCHEMBL12622805 | 0.85 | KDM1A (0.36) | OPRL1KDM1A | |
| SCHEMBL18314947 | 0.85 | CYP2C9 (0.32) | OPRL1CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL12623090 | 0.85 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180030351-A1 | LIQUID CRYSTAL COMPOUND HAVING POLYFLUORO-2-BUTENOXY GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2018-02-01 | — | — | US | disclosed |