Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 4/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.34 |
| ▸ | HTR1A | P08908 | 3/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL22732860 | 0.96 | CYP2C9 (0.45) | CYP2C9MAPTALDH1A1KMT2ALMNA | |
| SCHEMBL12032394 | 0.94 | CYP2C9 (0.38) | CYP2C9MAPTALDH1A1KMT2ALMNA | |
| SCHEMBL9925066 | 0.93 | CYP2C9 (0.37) | CYP2C9MAPTALDH1A1KMT2ALMNA | |
| SCHEMBL9925098 | 0.93 | CYP2C9 (0.39) | CYP2C9MAPTALDH1A1KMT2ALMNA | |
| SCHEMBL9924994 | 0.93 | CYP2C9 (0.37) | CYP2C9MAPTALDH1A1KMT2ALMNA | |
| SCHEMBL22277312 | 0.93 | CYP2C9 (0.42) | CYP2C9MAPTALDH1A1KMT2ALMNA | |
| SCHEMBL22277558 | 0.92 | SPHK1 (0.38) | CYP2C9MAPTALDH1A1KMT2ALMNA | |
| SCHEMBL9925033 | 0.90 | CYP2C9 (0.36) | CYP2C9MAPTALDH1A1KMT2ALMNA | |
| SCHEMBL12760287 | 0.90 | CYP2C9 (0.35) | CYP2C9MAPTALDH1A1KMT2ALMNA | |
| SCHEMBL12760400 | 0.90 | CYP2C9 (0.35) | CYP2C9MAPTALDH1A1KMT2ALMNA |
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 |