Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 3/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28088118 | 0.86 | DRD2 (0.34) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL27743971 | 0.85 | MAPT (0.37) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL6866538 | 0.83 | ESR2 (0.56) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL2768744 | 0.82 | CYP2C9 (0.57) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL7731635 | 0.82 | CYP2C9 (0.57) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL548537 | 0.80 | CYP2C9 (0.58) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL1790467 | 0.80 | CYP2C9 (0.58) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL548536 | 0.80 | CYP2C9 (0.58) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8448585 | 0.79 | CYP2C9 (0.57) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8448582 | 0.79 | CYP2C9 (0.57) | CYP2C9ALDH1A1MAPTLMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104045527-A | Difluoromethoxy-bridged derivative and preparation method and application | SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO LTD | 2014-09-17 | — | — | CN | disclosed |