Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TXN | P10599 | 1/20 | 0.33 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | HTR1D | P28221 | 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 | |
|---|---|---|---|---|
| SCHEMBL28443985 | 0.88 | ALDH1A1 (0.39) | CYP1A2CYP3A4CYP2D6CYP19A1CYP2C9 | |
| SCHEMBL1551505 | 0.82 | CYP3A4 (0.40) | CYP1A2CYP3A4CYP2D6CYP19A1CYP2C9 | |
| SCHEMBL7049007 | 0.79 | ALDH1A1 (0.42) | CYP1A2CYP3A4CYP2D6CYP19A1CYP2C9 | |
| Hexane SCHEMBL28148674 | 0.68 | ALDH1A1 (0.73) | CYP1A2CYP3A4CYP2D6CYP19A1CYP2C9 | |
| Decane SCHEMBL28760342 | 0.67 | ALDH1A1 (0.70) | CYP1A2CYP3A4CYP2D6CYP19A1CYP2C9 | |
| Octane SCHEMBL28838285 | 0.67 | ALDH1A1 (0.70) | CYP1A2CYP3A4CYP2D6CYP19A1CYP2C9 | |
| Nonane SCHEMBL27807437 | 0.67 | ALDH1A1 (0.70) | CYP1A2CYP3A4CYP2D6CYP19A1CYP2C9 | |
| SCHEMBL81566 | 0.67 | — | — | |
| SCHEMBL15140518 | 0.66 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2TXNTXNRD1TAAR1 | |
| SCHEMBL207 | 0.66 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111584841-B | Composite material, preparation method thereof and water-based lithium ion battery | 宁波锋成纳米科技有限公司 | 2021-07-27 | — | — | CN | claimed |
| CN-111584841-A | Composite material, preparation method thereof and water-based lithium ion battery | 宁波锋成纳米科技有限公司 | 2020-08-25 | — | — | CN | claimed |
| CN-111584841-B | Composite material, preparation method thereof and water-based lithium ion battery | 宁波锋成纳米科技有限公司 | 2021-07-27 | — | — | CN | disclosed |
| CN-111584841-A | Composite material, preparation method thereof and water-based lithium ion battery | 宁波锋成纳米科技有限公司 | 2020-08-25 | — | — | CN | disclosed |