Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FASN | P49327 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | APP | P05067 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | WNT1 | P04628 | 1/20 | 0.35 |
| ▸ | FPR2 | P25090 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6456896 | 0.87 | FASN (0.38) | FASNPDE3BPDE3AHTR1AHTR7 | |
| SCHEMBL6456894 | 0.87 | FASN (0.38) | FASNPDE3BPDE3AHTR1AHTR7 | |
| SCHEMBL13614719 | 0.87 | FASN (0.43) | FASNESR2PDE3BPDE3AHTR1A | |
| SCHEMBL10091178 | 0.87 | FASN (0.45) | FASNESR2CYP3A4APPCYP2C9 | |
| SCHEMBL20365954 | 0.84 | ESR2 (0.41) | FASNESR2PDE3BPDE3AHTR1A | |
| SCHEMBL16317705 | 0.84 | FASN (0.47) | FASNESR2PDE3BPDE3ACYP3A4 | |
| SCHEMBL12377041 | 0.83 | FASN (0.49) | FASNESR2CYP3A4APPCYP2C9 | |
| SCHEMBL17719303 | 0.83 | ESR2 (0.50) | FASNESR2CYP3A4APPCYP2C9 | |
| SCHEMBL13615663 | 0.83 | FASN (0.45) | FASNESR2PDE3BPDE3ACYP3A4 | |
| SCHEMBL91805 | 0.83 | FASN (0.45) | FASNESR2PDE3BPDE3ACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2116522-A1 | PENTACYCLIC LIQUID CRYSTAL COMPOUND HAVING CF<SB>2</SB>O BONDING GROUP, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY | Chisso Corporation (JP) | 2009-11-11 | — | — | EP | disclosed |