Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27715318 | 0.79 | TAAR1 (0.41) | TAAR1KCNN4MAPK1ALDH1A1TSHR | |
| SCHEMBL29211079 | 0.75 | CYP1A2 (0.41) | TAAR1KCNN4MAPK1ALDH1A1ALOX15 | |
| SCHEMBL15077740 | 0.75 | CYP1A2 (0.41) | TAAR1KCNN4MAPK1ALDH1A1ALOX15 | |
| SCHEMBL11216416 | 0.75 | ALDH1A1 (0.52) | TAAR1ALDH1A1TSHRALOX15ESR1 | |
| SCHEMBL10271603 | 0.73 | ALDH1A1 (0.41) | TAAR1MAPK1ALDH1A1ALOX15ESR1 | |
| SCHEMBL31314897 | 0.70 | CYP1A2 (0.43) | TAAR1KCNN4MAPK1ALDH1A1TSHR | |
| SCHEMBL28724527 | 0.70 | MAPK1 (0.37) | TAAR1KCNN4MAPK1ALDH1A1TSHR | |
| SCHEMBL27788155 | 0.70 | TAAR1 (0.48) | TAAR1KCNN4KIF11CYP1A2CYP3A4 | |
| SCHEMBL17974914 | 0.69 | CYP2C19 (0.41) | TAAR1KCNN4ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL17974909 | 0.69 | NR1H2 (0.44) | ALDH1A1TSHRCYP1A2CYP2C9CYP2C19 |
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-118472393-A | Sodium ion battery electrolyte, preparation method thereof, sodium ion battery and power utilization device | 江苏天合储能有限公司 | 2024-08-09 | — | — | CN | claimed |
| CN-118472393-A | Sodium ion battery electrolyte, preparation method thereof, sodium ion battery and power utilization device | 江苏天合储能有限公司 | 2024-08-09 | — | — | CN | disclosed |