Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.33 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.33 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.33 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1629992 | 0.88 | ALDH1A1 (0.50) | ALDH1A1TDP1ADRA2BPTGS1CYP1A2 | |
| SCHEMBL29365322 | 0.88 | ALDH1A1 (0.50) | ALDH1A1TDP1ADRA2BPTGS1CYP1A2 | |
| SCHEMBL28678398 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TDP1ADRA2BPTGS1CYP1A2 | |
| SCHEMBL28665189 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TDP1ADRA2BPTGS1CYP1A2 | |
| SCHEMBL28930064 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TDP1ADRA2BPTGS1CYP1A2 | |
| Hydrochloric Acid SCHEMBL28776334 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TDP1ADRA2BPTGS1CYP1A2 | |
| SCHEMBL29034620 | 0.79 | TSHR (0.47) | ALDH1A1TDP1KDM4EMAPTGAA | |
| SCHEMBL30426584 | 0.78 | HTR7 (0.36) | ALDH1A1CYP1A2CYP2C19CYP2C9MAPT | |
| SCHEMBL30586460 | 0.78 | ENPP2 (0.34) | CYP1A2KDM4EENPP2ORAI1ORAI2 | |
| SCHEMBL29220692 | 0.76 | RXRA (0.38) | ADRA2B |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110964046-B | Synthesis method of 2-nitrobenzoic acid pinacol ester | 安徽英特美科技有限公司 | 2023-05-05 | — | — | CN | claimed |
| CN-114901663-B | Aromatic heterocyclic compounds and application thereof in medicines | 上海喆邺生物科技有限公司 | 2024-07-02 | — | — | CN | disclosed |
| CN-117362298-A | Electroluminescent material and device | 北京夏禾科技有限公司 | 2024-01-09 | — | — | CN | disclosed |
| CN-113527317-B | Electroluminescent material and device | 北京夏禾科技有限公司 | 2023-12-26 | — | — | CN | disclosed |
| CN-117050134-A | Synthesis of amide compounds and uses thereof | 中国科学院上海有机化学研究所 | 2023-11-14 | — | — | CN | disclosed |
| CN-114249738-B | Electroluminescent material and device | 北京夏禾科技有限公司 | 2023-11-03 | — | — | CN | disclosed |
| CN-114256430-B | Electroluminescent device | 北京夏禾科技有限公司 | 2023-10-03 | — | — | CN | disclosed |
| CN-115403568-B | Quinazoline Aurora A covalent inhibitor and preparation method and application thereof | 中山大学 | 2023-09-29 | — | — | CN | disclosed |
| CN-116425724-A | Organic electroluminescent compound and organic electroluminescent device | 北京云基科技股份有限公司 | 2023-07-14 | — | — | CN | disclosed |
| CN-116396300-A | Organic electroluminescent compound and organic electroluminescent device | 北京云基科技股份有限公司 | 2023-07-07 | — | — | CN | disclosed |
| CN-111253422-B | Microelectrode for detecting hydrogen peroxide in blood and preparation method thereof | 商丘师范学院 | 2022-06-14 | — | — | CN | disclosed |
| CN-113563335-A | Organic electroluminescent material and device | 环球展览公司 | 2021-10-29 | — | — | CN | disclosed |
| CN-104974155-B | Organic electroluminescent material and device | 环球展览公司 | 2021-08-10 | — | — | CN | disclosed |
| CN-111253422-A | Microelectrode for detecting hydrogen peroxide in blood and preparation method thereof | 商丘师范学院 | 2020-06-09 | — | — | CN | disclosed |