Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 9/20 | 0.38 |
| ▸ | HTR6 | P50406 | 3/20 | 0.38 |
| ▸ | HTR2C | P28335 | 7/20 | 0.36 |
| ▸ | HTR2B | P41595 | 4/20 | 0.36 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.36 |
| ▸ | TMEM97 | Q5BJF2 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 5/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 3/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 2/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12740249 | 0.93 | DRD4 (0.38) | DRD4HTR6HTR2CHTR2BNAAA | |
| SCHEMBL14767246 | 0.91 | DRD4 (0.36) | DRD4HTR6NAAASIGMAR1TMEM97 | |
| SCHEMBL14767127 | 0.89 | DRD4 (0.40) | DRD4HTR6NAAASIGMAR1TMEM97 | |
| SCHEMBL14766702 | 0.89 | GYS1 (0.41) | HTR6NAAA | |
| SCHEMBL10302701 | 0.89 | HTR6 (0.39) | DRD4HTR6HTR2CHTR2BNAAA | |
| SCHEMBL12719099 | 0.88 | ALDH1A1 (0.35) | DRD4HTR6HTR2CHTR2BNAAA | |
| SCHEMBL14766904 | 0.88 | HTR2C (0.34) | DRD4HTR6HTR2CHTR2BLMNA | |
| SCHEMBL14766867 | 0.88 | GYS1 (0.38) | DRD4HTR6HTR2CHTR2BNAAA | |
| SCHEMBL14767031 | 0.88 | GABRA1 (0.35) | DRD4HTR6HTR2CHTR2BNAAA | |
| SCHEMBL12740342 | 0.88 | SIGMAR1 (0.40) | DRD4HTR6HTR2CHTR2BNAAA |
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-8394294-B2 | Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device | JNC CORPORATION (JP) | 2013-03-12 | — | — | US | disclosed |