Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | FDPS | P14324 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL554770 | 0.89 | CYP3A4 (0.55) | CYP3A4L3MBTL1ALDH1A1TDP1TSHR | |
| SCHEMBL9470459 | 0.87 | CYP3A4 (0.53) | CYP3A4L3MBTL1ALDH1A1TDP1TSHR | |
| SCHEMBL27593423 | 0.83 | CYP3A4 (0.55) | CYP3A4L3MBTL1ALDH1A1TDP1TSHR | |
| SCHEMBL28239735 | 0.83 | CYP3A4 (0.50) | CYP3A4L3MBTL1ALDH1A1TDP1TSHR | |
| SCHEMBL28812223 | 0.82 | CYP3A4 (0.48) | CYP3A4L3MBTL1ALDH1A1TDP1TSHR | |
| SCHEMBL5567064 | 0.81 | CYP3A4 (0.52) | CYP3A4L3MBTL1ALDH1A1TDP1TSHR | |
| SCHEMBL28285814 | 0.80 | TRPM8 (0.57) | CYP3A4L3MBTL1ALDH1A1TDP1TSHR | |
| SCHEMBL28111896 | 0.80 | TRPM8 (0.57) | CYP3A4L3MBTL1ALDH1A1TDP1TSHR | |
| SCHEMBL28208605 | 0.79 | CYP3A4 (0.46) | CYP3A4L3MBTL1ALDH1A1TDP1TSHR | |
| SCHEMBL27613222 | 0.78 | CYP3A4 (0.53) | CYP3A4L3MBTL1ALDH1A1TDP1TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109557204-A | The identification method of organic sulfur compound in a kind of rubber | 北京彤程创展科技有限公司 | 2019-04-02 | — | — | CN | disclosed |