Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | ERN1 | O75460 | 1/20 | 0.40 |
| ▸ | CES2 | O00748 | 2/20 | 0.37 |
| ▸ | CES1 | P23141 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| Formic Acid SCHEMBL27541441 | 0.85 | ERN1 (0.45) | ACHEERN1CES2CES1ESR1 | |
| SCHEMBL254224 | 0.84 | — | — | |
| Bromide SCHEMBL28030865 | 0.81 | ACHE (0.50) | ACHECES2CES1ESR1ESR2 | |
| SCHEMBL8820565 | 0.80 | TP53 (0.42) | ACHECES2CES1ESR1ESR2 | |
| SCHEMBL27516501 | 0.79 | CES2 (0.46) | ERN1CES2CES1HDAC4TDP1 | |
| Nitrogen SCHEMBL10700884 | 0.78 | ACHE (0.48) | ACHECES2CES1ESR1ESR2 | |
| SCHEMBL27263163 | 0.78 | NFE2L2 (0.46) | ACHEERN1CES2CES1SMN1; SMN2 | |
| SCHEMBL27329631 | 0.78 | ACHE (0.71) | ACHEERN1CES2CES1SMN1; SMN2 | |
| SCHEMBL27441274 | 0.77 | ERN1 (0.41) | ERN1CES2CES1SMN1; SMN2TDP1 | |
| SCHEMBL29956284 | 0.76 | ERN1 (0.57) | ACHEERN1TDP1ALDH1A1NFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105175284-B | Amides compound, preparation method and its medical usage | 中国药科大学 | 2017-06-16 | — | — | CN | disclosed |
| CN-105175284-A | Amide compounds, preparation method and medical use thereof | UNIV CHINA PHARMA | 2015-12-23 | — | — | CN | disclosed |