Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 6/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | MGAM | O43451 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | SI | P14410 | 1/20 | 0.30 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL777872 | 0.82 | ACHE (0.37) | ACHENFE2L2 | |
| SCHEMBL31408656 | 0.82 | ACHE (0.42) | ACHENFE2L2TAAR1CES2CES1 | |
| SCHEMBL776053 | 0.82 | ACHE (0.42) | ACHENFE2L2TAAR1CES2CES1 | |
| SCHEMBL776449 | 0.80 | NFE2L2 (0.42) | ACHENFE2L2CES2CES1 | |
| SCHEMBL7937933 | 0.79 | ACHE (0.34) | ACHENFE2L2 | |
| SCHEMBL775875 | 0.77 | ACHE (0.43) | ACHENFE2L2TAAR1CES2CES1 | |
| SCHEMBL779840 | 0.76 | NFE2L2 (0.36) | NFE2L2HTR2ACES2CES1GAA | |
| SCHEMBL27688794 | 0.75 | POLB (0.35) | NFE2L2ALDH1A1 | |
| SCHEMBL7938013 | 0.75 | NFE2L2 (0.39) | ACHENFE2L2TAAR1HTR2ACES2 | |
| SCHEMBL776964 | 0.74 | ACHE (0.44) | ACHENFE2L2TAAR1CES2CES1 |
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-6242654-B1 | REACTING A PHENOLATE COMPOUND WITH AN ORGANIC FLUORINATING AGENT TO PREPARE A FLUORINE SUBSTITUTED AROMATIC COMPOUND | MITSUI CHEMICALS, INC. (JP) | 2001-06-05 | — | — | US | disclosed |
| EP-1013629-A1 | Preparation process of fluorine subsituted aromatic compound | Mitsui Chemicals, Inc. (JP) | 2000-06-28 | — | — | EP | disclosed |