Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 6/20 | 0.60 |
| ▸ | CES1 | P23141 | 6/20 | 0.60 |
| ▸ | NAAA | Q02083 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Acetophenone SCHEMBL15206675 | 0.98 | CES2 (0.61) | CES2CES1NAAAMAPTSMN1; SMN2 | |
| Acetophenone SCHEMBL23581588 | 0.92 | CES2 (0.53) | CES2CES1NAAAMAPTSMN1; SMN2 | |
| Acetophenone SCHEMBL460178 | 0.91 | SMN1; SMN2 (0.60) | CES2CES1MAPTSMN1; SMN2LMNA | |
| Acetophenone SCHEMBL7731871 | 0.90 | CES2 (0.51) | CES2CES1NAAAMAPTSMN1; SMN2 | |
| Acetophenone SCHEMBL28080182 | 0.90 | CES2 (0.61) | CES2CES1MAPTALDH1A1 | |
| Acetophenone SCHEMBL11669848 | 0.90 | CES2 (0.61) | CES2CES1NAAAMAPTSMN1; SMN2 | |
| Acetophenone SCHEMBL18788593 | 0.90 | CES2 (0.51) | CES2CES1NAAAMAPTSMN1; SMN2 | |
| Acetophenone SCHEMBL9808838 | 0.89 | CES2 (0.62) | CES2CES1NAAAMAPTLMNA | |
| Methyl Nonyl Ketone SCHEMBL20856835 | 0.89 | CES2 (0.62) | CES2CES1NAAAMAPTLMNA | |
| Myristic Acid SCHEMBL2124139 | 0.89 | CES2 (0.62) | CES2CES1MAPTALDH1A1 |
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-107405337-A | Substituted chroman and application method | 艾伯维公司 | 2017-11-28 | — | — | CN | disclosed |