Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.38 |
| ▸ | FAAH | O00519 | 8/20 | 0.32 |
| ▸ | CES1 | P23141 | 5/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | FDPS | P14324 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15113878 | 0.80 | CES2 (0.31) | CES2FAAH | |
| SCHEMBL16077733 | 0.79 | CA1 (0.34) | — | |
| SCHEMBL4973972 | 0.77 | CES2 (0.35) | CES2FAAH | |
| SCHEMBL15423497 | 0.77 | BLM (0.36) | CES2MEN1KMT2A | |
| SCHEMBL28523838 | 0.76 | MAPT (0.35) | CES2 | |
| SCHEMBL21129444 | 0.76 | ODC1 (0.41) | CES2CYP1A2KMT2AFDPS | |
| SCHEMBL19501039 | 0.73 | CYP2C19 (0.31) | — | |
| SCHEMBL5138301 | 0.73 | CYP1A2 (0.43) | MEN1CYP1A2KMT2AHSD17B10FDPS | |
| SCHEMBL15424561 | 0.73 | ALDH1A1 (0.37) | CES2FAAHCES1MEN1CYP1A2 | |
| SCHEMBL21136397 | 0.73 | ALDH1A1 (0.31) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5057626-A | Difluoroketones from difluoroacylsilanes | PFIZER INC. (US) | 1991-10-15 | — | — | US | disclosed |
| US-4996345-A | Difluoroketones from difluoroacylsilanes | PFIZER INC. (US) | 1991-02-26 | — | — | US | disclosed |