Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.46 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CDC7 | O00311 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31633570 | 0.86 | CYP1A2 (0.56) | CYP1A2ALDH1A1TSHRMAPTCYP3A4 | |
| SCHEMBL5583438 | 0.86 | CYP1A2 (0.56) | CYP1A2ALDH1A1TSHRMAPTCYP3A4 | |
| SCHEMBL6940420 | 0.83 | GAA (0.57) | CYP1A2SMN1; SMN2GAAHTTALDH1A1 | |
| SCHEMBL506668 | 0.82 | CYP1A2 (0.58) | CYP1A2ALDH1A1TSHRGPR35HSD17B10 | |
| SCHEMBL9489211 | 0.82 | GAA (0.47) | CYP1A2GAAALDH1A1TSHRMAPT | |
| SCHEMBL5583370 | 0.77 | ALDH1A1 (0.52) | CYP1A2SMN1; SMN2GAAHTTALDH1A1 | |
| SCHEMBL13866738 | 0.77 | CYP3A4 (0.47) | CYP1A2SMN1; SMN2GAAHTTALDH1A1 | |
| SCHEMBL3697952 | 0.77 | CYP1A2 (0.59) | CYP1A2ALDH1A1TSHRCYP3A4GPR35 | |
| SCHEMBL17064547 | 0.75 | ALDH1A1 (0.45) | CYP1A2GAAALDH1A1TSHRMAPT | |
| SCHEMBL4622229 | 0.75 | ALDH1A1 (0.45) | CYP1A2GAAALDH1A1TSHRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021110890-A1 | PYRIDINIUM DERIVATIVES AS HERBICIDES | SYNGENTA CROP PROTECTION AG (CH) | 2021-06-10 | — | — | WO | disclosed |
| WO-2021110890-A1 | PYRIDINIUM DERIVATIVES AS HERBICIDES | SYNGENTA CROP PROTECTION AG (CH) | 2021-06-10 | — | — | WO | disclosed |