Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAK | O14976 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4376433 | 0.84 | HPGD (0.44) | SMN1; SMN2SYKCYP1A2CYP2D6CYP2C19 | |
| SCHEMBL31189728 | 0.81 | ENPP2 (0.32) | GAKSMN1; SMN2IDO1TDO2RUNX1 | |
| SCHEMBL31284870 | 0.78 | GAK (0.38) | GAKSMN1; SMN2IDO1TDO2MAOA | |
| SCHEMBL4074317 | 0.78 | ALDH1A1 (0.36) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4370260 | 0.77 | TDP1 (0.37) | GAKMAOACYP3A4 | |
| SCHEMBL16012069 | 0.77 | CYP1A2 (0.34) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4074314 | 0.77 | CYP1A2 (0.34) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL15112982 | 0.77 | MAOA (0.35) | GAKSMN1; SMN2MAOARIPK2COQ8A | |
| SCHEMBL30851753 | 0.77 | HPGD (0.40) | SMN1; SMN2TRPA1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7849683 | 0.77 | IKBKB (0.41) | TRPA1CYP1A2CYP3A4CYP2D6CYP2C9 |
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-114361590-B | Electrolyte additive for lithium ion battery, electrolyte and lithium ion battery | 松山湖材料实验室 | 2023-07-25 | — | — | CN | claimed |
| WO-2009103950-A1 | FLUORINATED PYRIDIN-4-0NES | BTG INTERNATIONAL LIMITED (GB) | 2009-08-27 | — | — | WO | disclosed |