Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 2/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | DBH | P09172 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL13661724 | 0.86 | CYP2D6 (0.46) | CYP1A2CYP2D6CYP2C19PPARAMAPT | |
| SCHEMBL13867764 | 0.84 | PPARA (0.32) | CYP1A2CYP2D6CYP2C19PPARAMAPT | |
| SCHEMBL12325066 | 0.78 | CYP1A2 (0.31) | CYP1A2CYP2D6CYP2C19F10 | |
| SCHEMBL14211082 | 0.77 | CYP2D6 (0.45) | CYP1A2CYP2D6CYP2C19PPARAMAPT | |
| SCHEMBL22446847 | 0.76 | ALDH1A1 (0.38) | CYP1A2CYP2D6CYP2C19PPARALMNA | |
| SCHEMBL19805249 | 0.75 | PPARA (0.34) | CYP1A2CYP2D6CYP2C19PPARAPPARG | |
| SCHEMBL23870271 | 0.75 | HTT (0.39) | CYP1A2PPARAMAPTGAALMNA | |
| SCHEMBL16578017 | 0.74 | CYP1A2 (0.40) | CYP1A2CYP2D6CYP2C19PPARAESR1 | |
| SCHEMBL13359360 | 0.74 | MAPT (0.40) | CYP1A2CYP2D6CYP2C19PPARAMAPT | |
| SCHEMBL13661695 | 0.72 | MAPT (0.49) | PPARAMAPTGAALMNATDP1 |
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-2011118845-A1 | POLYESTER RESIN, AND OPTICAL MATERIALS, FILMS AND IMAGE DISPLAY DEVICES USING THE SAME | FUJIFILM CORPORATION (JP) | 2011-09-29 | — | — | WO | disclosed |