Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 10/20 | 1.00 |
| ▸ | MAPT | P10636 | 6/20 | 1.00 |
| ▸ | MAOB | P27338 | 6/20 | 1.00 |
| ▸ | LMNA | P02545 | 2/20 | 1.00 |
| ▸ | BCHE | P06276 | 2/20 | 1.00 |
| ▸ | TNFRSF1A | P19438 | 2/20 | 1.00 |
| ▸ | PLIN1 | O60240 | 1/20 | 1.00 |
| ▸ | ACHE | P22303 | 1/20 | 1.00 |
| ▸ | RECQL | P46063 | 1/20 | 1.00 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 1.00 |
| ▸ | ABHD5 | Q8WTS1 | 1/20 | 1.00 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.78 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.78 |
| ▸ | HSPD1 | P10809 | 3/20 | 0.78 |
| ▸ | HSPE1 | P61604 | 3/20 | 0.78 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.78 |
| ▸ | RAB9A | P51151 | 2/20 | 0.78 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.78 |
| ▸ | RELA | Q04206 | 2/20 | 0.78 |
| ▸ | MEN1 | O00255 | 2/20 | 0.78 |
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 | |
|---|---|---|---|---|
| Chalcone SCHEMBL454583 | 1.00 | CYP1B1 (1.00) | CYP1B1MAPTMAOBLMNABCHE | |
| Chalcone SCHEMBL29922932 | 1.00 | CYP1B1 (1.00) | CYP1B1MAPTMAOBLMNABCHE | |
| Chalcone SCHEMBL27580 | 1.00 | CYP1B1 (1.00) | CYP1B1MAPTMAOBLMNABCHE | |
| Chalcone SCHEMBL28306720 | 1.00 | CYP1B1 (1.00) | CYP1B1MAPTMAOBLMNABCHE | |
| Chalcone SCHEMBL27581 | 1.00 | CYP1B1 (1.00) | CYP1B1MAPTMAOBLMNABCHE | |
| Chalcone SCHEMBL2404758 | 1.00 | CYP1B1 (1.00) | CYP1B1MAPTMAOBLMNABCHE | |
| Chalcone SCHEMBL2427445 | 0.98 | CYP1B1 (0.96) | CYP1B1MAPTMAOBLMNABCHE | |
| Chalcone SCHEMBL527181 | 0.98 | CYP1B1 (0.96) | CYP1B1MAPTMAOBLMNABCHE | |
| Chalcone SCHEMBL7861207 | 0.98 | CYP1B1 (0.96) | CYP1B1MAPTMAOBLMNABCHE | |
| Chalcone SCHEMBL7653806 | 0.98 | CYP1B1 (0.96) | CYP1B1MAPTMAOBLMNABCHE |
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-114075138-A | Stable isotope labeled difenzoquat and synthetic method thereof | 上海安谱实验科技股份有限公司 | 2022-02-22 | — | — | CN | claimed |
| CN-114075138-A | Stable isotope labeled difenzoquat and synthetic method thereof | 上海安谱实验科技股份有限公司 | 2022-02-22 | — | — | CN | disclosed |
| CN-114075138-A | Stable isotope labeled difenzoquat and synthetic method thereof | 上海安谱实验科技股份有限公司 | 2022-02-22 | — | — | CN | disclosed |