Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | FASN | P49327 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | APP | P05067 | 2/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 9/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | VRK1 | Q99986 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | QDPR | P09417 | 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 | |
|---|---|---|---|---|
| SCHEMBL91870 | 0.88 | FASN (0.43) | ESR2FASNCYP3A4CYP2C9APP | |
| SCHEMBL91927 | 0.87 | FASN (0.42) | ESR2FASNCYP3A4CYP2C9APP | |
| SCHEMBL4431638 | 0.87 | FASN (0.42) | ESR2FASNCYP3A4CYP2C9APP | |
| SCHEMBL14206989 | 0.85 | FASN (0.41) | ESR2FASNCYP3A4CYP2C9APP | |
| SCHEMBL13614726 | 0.85 | FASN (0.41) | ESR2FASNCYP3A4CYP2C9APP | |
| SCHEMBL14206983 | 0.85 | FASN (0.41) | ESR2FASNCYP3A4CYP2C9APP | |
| SCHEMBL13614719 | 0.85 | FASN (0.43) | ESR2FASNCYP3A4CYP2C9APP | |
| SCHEMBL1754921 | 0.85 | FASN (0.42) | ESR2FASNCYP3A4CYP2C9APP | |
| SCHEMBL12377041 | 0.84 | FASN (0.49) | ESR2FASNCYP3A4CYP2C9APP | |
| SCHEMBL17719303 | 0.84 | ESR2 (0.50) | ESR2FASNCYP3A4CYP2C9APP |
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-20080121843-A1 | Liquid crystals having a terminal polar radical and a terminal CH3 group and simultaneously having very high specific resistances and low threshold voltages requiring a high clearing point and low rotational viscosity; matrices | HECKMEIER MICHAEL | 2008-05-29 | — | — | US | disclosed |