Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.69 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.69 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.46 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.46 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.46 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.46 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.46 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.46 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.46 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL31526143 | 0.88 | PTGS2 (0.63) | PTGS2PTGS1CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL4974872 | 0.84 | PTGS2 (0.58) | PTGS2PTGS1CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL27749854 | 0.84 | PTGS2 (0.58) | PTGS2PTGS1CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL2279510 | 0.81 | PTGS2 (1.00) | PTGS2PTGS1CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL10078260 | 0.81 | PTGS2 (0.69) | PTGS2PTGS1CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL256699 | 0.81 | PTGS1 (0.59) | PTGS2PTGS1GABRA5ALDH1A1NPSR1 | |
| SCHEMBL7375447 | 0.80 | PTGS1 (0.46) | PTGS2PTGS1CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL12088074 | 0.80 | PTGS2 (0.67) | PTGS2PTGS1CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL2473730 | 0.76 | PTGS1 (0.61) | PTGS2PTGS1CYP1A1CYP1A2CYP2E1 | |
| SCHEMBL5729456 | 0.75 | PTGS2 (0.44) | PTGS2PTGS1CYP1A2CYP2C19GABRA5 |
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-114773284-A | Synthesis method of visible light mediated dihydroisoxazole | 河南大学 | 2022-07-22 | — | — | CN | disclosed |