Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | TMPRSS15 | P98073 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 5/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11943805 | 0.89 | PDE2A (0.33) | PTGS1PTGS2HIF1APDE2ACES2 | |
| SCHEMBL11943794 | 0.86 | PDE2A (0.31) | PDE2ACES2CES1 | |
| SCHEMBL12836053 | 0.86 | PDE2A (0.31) | PDE2ACES2CES1 | |
| SCHEMBL11939108 | 0.86 | ESR1 (0.34) | PTGS1PTGS2 | |
| SCHEMBL12224654 | 0.83 | PDE2A (0.32) | PDE2ACES2CES1 | |
| SCHEMBL12836075 | 0.81 | PDE2A (0.32) | PRSS1TMPRSS15PDE2A | |
| SCHEMBL12836555 | 0.81 | PIM1 (0.34) | PTGS1PTGS2 | |
| SCHEMBL11943721 | 0.81 | PDE4A (0.30) | — | |
| SCHEMBL12836541 | 0.80 | MAOB (0.38) | — | |
| SCHEMBL13586141 | 0.80 | CYP1A2 (0.33) | PDE2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011033937-A1 | LIQUID CRYSTALLINE COMPOUND, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT | チッソ株式会社 (JP) | 2011-03-24 | — | — | WO | disclosed |