Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.38 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.37 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | WNT3A | P56704 | 1/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.33 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13621554 | 0.82 | CASP3 (0.40) | CYP2A6CYP2B6CYP2E1CASP3SENP8 | |
| SCHEMBL132013 | 0.77 | KCNH2 (0.49) | KCNH2HRH3LTA4H | |
| SCHEMBL5761853 | 0.74 | MAPT (0.42) | KCNH2HRH3LTA4H | |
| SCHEMBL3794785 | 0.72 | KCNH2 (0.38) | KCNH2HRH3LTA4H | |
| SCHEMBL21351777 | 0.71 | KCNN4 (0.47) | KCNH2HRH3LTA4H | |
| SCHEMBL84185 | 0.71 | KCNN4 (0.47) | KCNH2HRH3LTA4H | |
| SCHEMBL28203914 | 0.71 | MAPT (0.44) | KCNH2HRH3LTA4H | |
| SCHEMBL105809 | 0.69 | NPC1 (0.41) | KCNH2HRH3LTA4H | |
| SCHEMBL10520360 | 0.69 | KCNH2 (0.48) | KCNH2HRH3LTA4H | |
| SCHEMBL9475161 | 0.69 | KCNH2 (0.44) | KCNH2HRH3LTA4H |
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-119899180-A | Chiral oxazoline diester derivative and preparation method and application thereof | 安徽农业大学 | 2025-04-29 | — | — | CN | disclosed |