Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | SCN1A | P35498 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL425880 | 0.83 | S1PR5 (0.38) | PDK2CYP1A2CYP2C9CYP2C19MAPK1 | |
| SCHEMBL12733575 | 0.81 | ALDH1A1 (0.33) | PDK2MAPK1ALDH1A1LMNA | |
| SCHEMBL12821170 | 0.80 | — | — | |
| SCHEMBL2507025 | 0.78 | ALDH1A1 (0.38) | PDK2CYP2C9CYP2C19ALDH1A1KCNH2 | |
| SCHEMBL14765748 | 0.78 | GPR119 (0.39) | CYP1A2CYP19A1CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL1243493 | 0.75 | ALDH1A1 (0.40) | PDK2CYP2C9CYP2C19ALDH1A1USP2 | |
| SCHEMBL426306 | 0.74 | GPR119 (0.35) | ALDH1A1GPR119USP2 | |
| SCHEMBL9494594 | 0.71 | NR5A1 (0.56) | CYP1A2CYP19A1CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL9496980 | 0.71 | NR5A1 (0.56) | CYP1A2CYP19A1CYP2C9CYP2C19CYP2D6 | |
| SCHEMBL9494586 | 0.71 | NR5A1 (0.56) | CYP1A2CYP19A1CYP2C9CYP2C19CYP2D6 |
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 |