Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | FPR2 | P25090 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL8970556 | 1.00 | GRIN1 (0.32) | GRIN1GRIN2BADRB2HTR1ASLC6A2 | |
| SCHEMBL8970844 | 1.00 | GRIN1 (0.32) | GRIN1GRIN2BADRB2HTR1ASLC6A2 | |
| SCHEMBL12759837 | 0.94 | ESR1 (0.33) | GRIN1GRIN2BALDH1A1FPR2TDP1 | |
| SCHEMBL13000851 | 0.93 | NAAA (0.34) | GRIN1GRIN2BFPR2HRH3 | |
| SCHEMBL12759921 | 0.91 | ESR1 (0.33) | GRIN1GRIN2BALDH1A1FPR2TDP1 | |
| SCHEMBL8970464 | 0.91 | FFAR4 (0.33) | GRIN1GRIN2BFPR2ESR1 | |
| SCHEMBL12759910 | 0.90 | CHRM2 (0.34) | ALDH1A1TDP1MAPT | |
| SCHEMBL8969153 | 0.89 | SLC6A2 (0.30) | GRIN1GRIN2BSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8969170 | 0.89 | SLC6A2 (0.30) | GRIN1GRIN2BSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL12759873 | 0.88 | CHRM2 (0.33) | ALDH1A1FPR2GAAMAPT |
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-8187494-B2 | Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device | JNC CORPORATION (JP) | 2012-05-29 | — | — | US | disclosed |