Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CES2 | O00748 | 2/20 | 0.36 |
| ▸ | CES1 | P23141 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.35 |
| ▸ | FFAR3 | O14843 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CTSD | P07339 | 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 | |
|---|---|---|---|---|
| SCHEMBL28073260 | 0.77 | LMNA (0.33) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| SCHEMBL3843515 | 0.74 | ALDH1A1 (0.44) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| SCHEMBL17730361 | 0.74 | — | — | |
| SCHEMBL5405818 | 0.74 | — | — | |
| SCHEMBL6860287 | 0.73 | CES2 (0.41) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| SCHEMBL3236585 | 0.73 | ALDH1A1 (0.42) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| SCHEMBL7264034 | 0.71 | TSHR (0.42) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| SCHEMBL17909924 | 0.71 | — | — | |
| SCHEMBL11727566 | 0.70 | CES1 (0.43) | ALDH1A1CES2CES1HDAC3HDAC1 | |
| SCHEMBL11556450 | 0.70 | CES1 (0.43) | ALDH1A1CES2CES1HDAC3HDAC1 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-209052604-U | Ethyl cyanoacetate synthesis system | 营创三征(营口)精细化工有限公司 | 2019-07-02 | — | — | CN | disclosed |
| CN-109265368-A | Ethyl cyanoacetate synthesis technology | 营创三征(营口)精细化工有限公司 | 2019-01-25 | — | — | CN | disclosed |
| CN-109020836-A | A kind of synthetic method of ethyl cyanoacetate | 营创三征(营口)精细化工有限公司 | 2018-12-18 | — | — | CN | disclosed |
| CN-207537374-U | Batch reactive distillation production cyanoacetate compound, malonate compound device | 烟台国邦化工机械科技有限公司 | 2018-06-26 | — | — | CN | disclosed |
| CN-207537372-U | Continuous reaction rectification production cyanoacetate compound, malonate compound device | 烟台国邦化工机械科技有限公司 | 2018-06-26 | — | — | CN | disclosed |
| CN-207537373-U | A kind of continuous rectification refines cyanoacetate compound device | 烟台国邦化工机械科技有限公司 | 2018-06-26 | — | — | CN | disclosed |
| CN-107986963-A | A kind of continuous production cyanoacetate compound, the technique of malonate compound | 烟台国邦化工机械科技有限公司 | 2018-05-04 | — | — | CN | disclosed |
| CN-107840808-A | Continuous reaction rectification production cyanoacetate compound, malonate compound device and its production technology | 烟台国邦化工机械科技有限公司 | 2018-03-27 | — | — | CN | disclosed |
| CN-107827778-A | A kind of continuous rectification refines cyanoacetate compound device and its technique | 烟台国邦化工机械科技有限公司 | 2018-03-23 | — | — | CN | disclosed |
| CN-107827779-A | Batch reactive distillation production cyanoacetate compound, malonate compound device and its production technology | 烟台国邦化工机械科技有限公司 | 2018-03-23 | — | — | CN | disclosed |