Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.58 |
| ▸ | CES1 | P23141 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | SMO | Q99835 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | TYK2 | P29597 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.44 |
| ▸ | FEN1 | P39748 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL17187884 | 0.93 | CES2 (0.65) | CES2CES1POLBALDH1A1HPGD | |
| SCHEMBL29875158 | 0.93 | CES2 (0.65) | CES2CES1POLBALDH1A1HPGD | |
| SCHEMBL55443 | 0.93 | CES2 (0.65) | CES2CES1POLBALDH1A1HPGD | |
| Water SCHEMBL7070088 | 0.91 | CES2 (0.62) | CES2CES1POLBALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL27995982 | 0.91 | CES2 (0.62) | CES2CES1POLBALDH1A1HPGD | |
| Methyl Alcohol SCHEMBL28944135 | 0.91 | CES2 (0.62) | CES2CES1POLBALDH1A1HPGD | |
| SCHEMBL2153679 | 0.79 | CES2 (0.48) | CES2CES1POLBALDH1A1HPGD | |
| SCHEMBL255022 | 0.78 | POLB (0.67) | CES2CES1POLBALDH1A1HPGD | |
| SCHEMBL29482203 | 0.78 | POLB (0.67) | CES2CES1POLBALDH1A1HPGD | |
| Ethyl Acetate SCHEMBL28944126 | 0.77 | TSHR (0.52) | CES2CES1POLBALDH1A1HPGD |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100569726-C | The synthesis technique of mesitylene carboxylic acid | CNPC JINZHOU PETROCHEMICAL COR (CN) | 2009-12-16 | — | — | CN | claimed |
| CN-1927800-A | Synthesis process of 2,4,6-trimethyl benzoic acid | JINZHOU PETROCHEMICAL CORP CNP (CN) | 2007-03-14 | — | — | CN | claimed |
| CN-102491894-A | Preparation method of 2,4,6-trimethylbenzoic acid | TAIAN BOYANG CHEMICAL TECHNOLOGY CO LTD | 2012-06-13 | — | — | CN | disclosed |
| CN-100569726-C | The synthesis technique of mesitylene carboxylic acid | CNPC JINZHOU PETROCHEMICAL COR (CN) | 2009-12-16 | — | — | CN | disclosed |
| CN-1927800-A | Synthesis process of 2,4,6-trimethyl benzoic acid | JINZHOU PETROCHEMICAL CORP CNP (CN) | 2007-03-14 | — | — | CN | disclosed |