Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.56 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.50 |
| ▸ | FDPS | P14324 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | SCN1A | P35498 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21353 | 0.97 | SLC6A2 (0.58) | SLC6A2TAAR1CYP2C19CYP2C9CYP1A2 | |
| Bromide SCHEMBL28597373 | 0.95 | SLC6A2 (0.56) | SLC6A2TAAR1CYP2C19CYP2C9CYP1A2 | |
| SCHEMBL28101998 | 0.95 | SLC6A2 (0.56) | SLC6A2TAAR1CYP2C19CYP2C9CYP1A2 | |
| SCHEMBL28101982 | 0.95 | SLC6A2 (0.56) | SLC6A2TAAR1CYP2C19CYP2C9CYP1A2 | |
| SCHEMBL28366661 | 0.95 | SLC6A2 (0.56) | SLC6A2TAAR1CYP2C19CYP2C9CYP1A2 | |
| Acetic Acid SCHEMBL1551090 | 0.89 | HIF1A (0.50) | SLC6A2TAAR1CYP2C19CYP2C9CYP1A2 | |
| SCHEMBL23924264 | 0.85 | SLC6A2 (0.47) | SLC6A2TAAR1CYP2C19CYP2C9CYP1A2 | |
| Phenylethyl Alcohol SCHEMBL1871465 | 0.85 | TDP1 (0.64) | SLC6A2TAAR1CYP2C19CYP2C9CYP1A2 | |
| SCHEMBL6565911 | 0.83 | TRPA1 (0.50) | SLC6A2TAAR1CYP2C19CYP2C9CYP1A2 | |
| Benzophenone SCHEMBL27920919 | 0.83 | ALDH1A1 (0.54) | SLC6A2TAAR1CYP2C19CYP2C9CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110540610-A | (methyl) acrylate polymer and preparation method thereof | ZHEJIANG RES INST CHEMICAL IND LTD | 2019-12-06 | — | — | CN | claimed |
| CN-110540610-B | (methyl) acrylate polymer and preparation method thereof | 浙江省化工研究院有限公司 | 2021-08-20 | — | — | CN | disclosed |
| CN-110540610-A | (methyl) acrylate polymer and preparation method thereof | ZHEJIANG RES INST CHEMICAL IND LTD | 2019-12-06 | — | — | CN | disclosed |