Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8573016 | 1.00 | KEAP1 (0.39) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL25376 | 0.81 | KEAP1 (0.39) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL6050060 | 0.81 | KEAP1 (0.39) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| Hydrochloric Acid SCHEMBL25753 | 0.80 | MEN1 (0.39) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL6049989 | 0.69 | CYP2C19 (0.32) | CHRM2CHRM1CHRM3KCNH2CYP2C19 | |
| Hydrochloric Acid SCHEMBL18690724 | 0.67 | MEN1 (0.39) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL15675855 | 0.65 | KEAP1 (0.47) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL8573019 | 0.65 | KEAP1 (0.52) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL6253388 | 0.65 | KEAP1 (0.46) | KEAP1NFE2L2CHRM2CHRM1CHRM3 | |
| SCHEMBL5685995 | 0.63 | CHRM2 (0.42) | KEAP1NFE2L2CHRM2CHRM1CHRM3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1424321-B1 | Synthesis of optically active cyclohexylphenylglycolate esters | SEPRACOR INC (US) | 2006-07-05 | — | — | EP | claimed |