Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL7022197 | 0.75 | — | — | |
| SCHEMBL1297635 | 0.73 | — | — | |
| SCHEMBL28145130 | 0.73 | — | — | |
| SCHEMBL7063983 | 0.73 | ALDH1A1 (0.33) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL506084 | 0.71 | CES2 (0.47) | ALDH1A1CES2CES1FFAR3HDAC3 | |
| SCHEMBL5047501 | 0.71 | — | — | |
| SCHEMBL25820249 | 0.71 | — | — | |
| SCHEMBL10493583 | 0.69 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL12653916 | 0.69 | — | — | |
| SCHEMBL12124916 | 0.69 | — | — |
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-107840905-A | A kind of ingredient of solid catalyst, catalyst system and pre-polymerized catalyst for olefinic polymerization | 中国石油化工股份有限公司 | 2018-03-27 | — | — | CN | disclosed |
| CN-107840909-A | A kind of ingredient of solid catalyst, catalyst system and pre-polymerized catalyst for olefinic polymerization | 中国石油化工股份有限公司 | 2018-03-27 | — | — | CN | disclosed |