Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9405829 | 0.92 | KDM1A (0.35) | CYP2C9ALDH1A1MAPTLMNAKDM1A | |
| SCHEMBL3437363 | 0.92 | KDM1A (0.35) | CYP2C9ALDH1A1MAPTLMNAKDM1A | |
| SCHEMBL9405767 | 0.92 | CYP2C9 (0.41) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL9405770 | 0.92 | CYP2C9 (0.41) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL22277321 | 0.90 | CYP2C9 (0.37) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL12739663 | 0.89 | CYP2C9 (0.33) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL12734852 | 0.89 | CYP2C9 (0.33) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL22277588 | 0.89 | SPHK1 (0.36) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL22277645 | 0.89 | CYP2C9 (0.39) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL22277743 | 0.89 | CYP2C9 (0.39) | CYP2C9MEN1KMT2AALDH1A1MAPT |
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-20200239775-A1 | TETRACYCLIC LIQUID CRYSTAL COMPOUND HAVING DIATOMIC BONDING GROUP AND 2,3-DIFLUOROPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE | JNC CORPORATION (JP) | 2020-07-30 | — | — | US | disclosed |