Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.61 |
| ▸ | CES1 | P23141 | 2/20 | 0.61 |
| ▸ | F3 | P13726 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 5/20 | 0.59 |
| ▸ | CA2 | P00918 | 5/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | PARP1 | P09874 | 1/20 | 0.57 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.57 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.57 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | MAOB | P27338 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.56 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL7000262 | 0.84 | F3 (0.75) | CES2CES1F3MAPTALDH1A1 | |
| SCHEMBL7000261 | 0.84 | F3 (0.75) | CES2CES1F3MAPTALDH1A1 | |
| SCHEMBL5468041 | 0.83 | F3 (0.68) | CES2CES1F3MAPTALDH1A1 | |
| SCHEMBL11807743 | 0.83 | F3 (0.68) | CES2CES1F3MAPTALDH1A1 | |
| SCHEMBL5468035 | 0.83 | F3 (0.68) | CES2CES1F3MAPTALDH1A1 | |
| SCHEMBL1641142 | 0.83 | CES2 (0.61) | CES2CES1F3MAPTALDH1A1 | |
| SCHEMBL3983289 | 0.81 | F3 (0.59) | CES2CES1F3MAPTALDH1A1 | |
| SCHEMBL546672 | 0.81 | F3 (0.59) | CES2CES1F3MAPTALDH1A1 | |
| Water SCHEMBL3047437 | 0.81 | F3 (0.59) | CES2CES1F3MAPTALDH1A1 | |
| SCHEMBL19309804 | 0.81 | F3 (0.59) | CES2CES1F3MAPTALDH1A1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106242968-B | By α, method that β unsaturated carboxylic acids and ketone compounds directly synthesize the alpha-acyloxy ketone derivatives containing ethylenic unsaturation | 沅江华龙催化科技有限公司 | 2018-11-06 | — | — | CN | disclosed |
| CN-106220495-B | The method that the alpha-acyloxy ketone derivatives containing ethylenic unsaturation are directly synthesized by α-reaction kinetic of ketone | 沅江华龙催化科技有限公司 | 2018-10-26 | — | — | CN | disclosed |
| CN-106220496-B | By α, method that β unsaturated carboxylic acids and phenylpropyl alcohol ketone class compound directly synthesize the alpha-acyloxy ketone derivatives containing ethylenic unsaturation | 沅江华龙催化科技有限公司 | 2018-10-26 | — | — | CN | disclosed |
| CN-106242968-A | The method being directly synthesized α acyloxy ketone derivatives containing ethylenic unsaturation by α, β unsaturated carboxylic acid and ketone compounds | 沅江华龙催化科技有限公司 | 2016-12-21 | — | — | CN | disclosed |
| CN-106220495-A | The method being directly synthesized α acyloxy ketone derivatives containing ethylenic unsaturation by the α reaction kinetic of ketone | 沅江华龙催化科技有限公司 | 2016-12-14 | — | — | CN | disclosed |
| CN-106220496-A | The method being directly synthesized α acyloxy ketone derivatives containing ethylenic unsaturation by α, β unsaturated carboxylic acid and propiophenone compounds | 沅江华龙催化科技有限公司 | 2016-12-14 | — | — | CN | disclosed |