Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | KLK5 | Q9Y337 | 2/20 | 0.54 |
| ▸ | JAK3 | P52333 | 1/20 | 0.53 |
| ▸ | BTK | Q06187 | 1/20 | 0.53 |
| ▸ | PPARA | Q07869 | 6/20 | 0.51 |
| ▸ | PPARG | P37231 | 5/20 | 0.51 |
| ▸ | PPARD | Q03181 | 2/20 | 0.51 |
| ▸ | CTSS | P25774 | 4/20 | 0.49 |
| ▸ | CTSK | P43235 | 4/20 | 0.49 |
| ▸ | CTSL | P07711 | 1/20 | 0.48 |
| ▸ | CTSB | P07858 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | ACE | P12821 | 1/20 | 0.46 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28905329 | 0.89 | PPARA (0.59) | KMT2AJAK3BTKPPARAPPARG | |
| SCHEMBL4802016 | 0.89 | PPARA (0.59) | KMT2AJAK3BTKPPARAPPARG | |
| SCHEMBL3884513 | 0.89 | PPARA (0.59) | KMT2AJAK3BTKPPARAPPARG | |
| SCHEMBL30543584 | 0.87 | KLK5 (0.50) | KMT2AKLK5JAK3BTKPPARA | |
| SCHEMBL20117226 | 0.87 | JAK3 (0.53) | KMT2AKLK5JAK3BTKPPARA | |
| SCHEMBL13866876 | 0.86 | REN (0.48) | KMT2AKLK5JAK3BTKPPARA | |
| SCHEMBL3881492 | 0.86 | REN (0.48) | KMT2AKLK5JAK3BTKPPARA | |
| SCHEMBL29750260 | 0.85 | CTSS (0.55) | CTSSCTSKCTSLCTSB | |
| SCHEMBL2344991 | 0.84 | KLK5 (0.57) | KLK5PPARAPPARGPPARDCTSS | |
| SCHEMBL2344987 | 0.84 | KLK5 (0.57) | KLK5PPARAPPARGPPARDCTSS |
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-114950558-B | Bipiperidine skeleton tetradentate nitrogen-containing manganese catalyst and method for catalyzing hydrocarbon molecule benzyl site selective oxidation by using same | 陕西师范大学 | 2023-08-11 | — | — | CN | disclosed |
| CN-114950558-A | Bipiperidine skeleton tetradentate nitrogen-containing manganese catalyst and method for catalyzing benzyl-site selective oxidation of hydrocarbon molecules by using same | 陕西师范大学 | 2022-08-30 | — | — | CN | disclosed |
| EP-1355978-B1 | SURFACE-FUNCTIONALISED CARRIER MATERIAL, METHOD FOR THE PRODUCTION THEREOF AND SOLID PHASE SYNTHESIS METHOD | POLY AN GES ZUR HERSTELLUNG VO (DE) | 2004-08-04 | — | — | EP | disclosed |