Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 6/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 2/20 | 0.31 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL12759226 | 1.00 | HRH3 (0.37) | HRH3HTR2AHTR2BADRB2HTR1A | |
| SCHEMBL12759213 | 0.93 | KCNH2 (0.34) | HRH3SLC6A2SLC6A4SLC6A3DRD4 | |
| SCHEMBL12759235 | 0.92 | HTR2B (0.33) | HRH3HTR2AHTR2BADRB2HTR1A | |
| SCHEMBL12759245 | 0.91 | SMN1; SMN2 (0.35) | HRH3ALDH1A1GLAKCNH2 | |
| SCHEMBL12759229 | 0.90 | HRH3 (0.36) | HRH3HTR2AHTR2BADRB2HTR1A | |
| SCHEMBL12760346 | 0.90 | HRH3 (0.36) | HRH3HTR2AHTR2BADRB2HTR1A | |
| SCHEMBL12760085 | 0.90 | HRH3 (0.36) | HRH3HTR2AHTR2BADRB2HTR1A | |
| SCHEMBL12759118 | 0.90 | HTR2C (0.35) | HRH3HTR2AHTR2BADRB2HTR1A | |
| SCHEMBL12759227 | 0.88 | HRH3 (0.35) | HRH3HTR2AHTR2BADRB2HTR1A | |
| SCHEMBL12759230 | 0.87 | HRH3 (0.34) | HRH3HTR2AHTR2BADRB2HTR1A |
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 |