Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 2/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.76 |
| ▸ | MAPT | P10636 | 3/20 | 0.76 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.76 |
| ▸ | USP2 | O75604 | 1/20 | 0.76 |
| ▸ | LMNA | P02545 | 1/20 | 0.76 |
| ▸ | ELANE | P08246 | 1/20 | 0.76 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.76 |
| ▸ | BCL2 | P10415 | 1/20 | 0.75 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.72 |
| ▸ | MEN1 | O00255 | 2/20 | 0.72 |
| ▸ | POLB | P06746 | 2/20 | 0.72 |
| ▸ | GAA | P10253 | 2/20 | 0.72 |
| ▸ | RECQL | P46063 | 2/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.72 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.72 |
| ▸ | NPC1 | O15118 | 1/20 | 0.70 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.70 |
| ▸ | THRB | P10828 | 1/20 | 0.70 |
| ▸ | APEX1 | P27695 | 1/20 | 0.70 |
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 | |
|---|---|---|---|---|
| SCHEMBL1155799 | 0.92 | BCL2 (0.75) | MAPTBCL2KDM4EMEN1POLB | |
| SCHEMBL30445844 | 0.92 | BCL2 (0.79) | PPARGALDH1A1MAPTMAPK1CYP3A4 | |
| SCHEMBL1764426 | 0.92 | BCL2 (0.79) | PPARGALDH1A1MAPTMAPK1CYP3A4 | |
| SCHEMBL1764085 | 0.90 | ALDH1A1 (0.84) | PPARGALDH1A1MAPTMAPK1USP2 | |
| SCHEMBL10997058 | 0.90 | ALDH1A1 (0.88) | PPARGALDH1A1MAPTMAPK1USP2 | |
| SCHEMBL29929179 | 0.88 | ALDH1A1 (0.78) | PPARGALDH1A1MAPTMAPK1USP2 | |
| SCHEMBL2139264 | 0.88 | ALDH1A1 (0.78) | PPARGALDH1A1MAPTMAPK1USP2 | |
| SCHEMBL27221222 | 0.87 | KDM4E (0.72) | ALDH1A1MAPTBCL2KDM4EMEN1 | |
| Xanthomicrol SCHEMBL6257160 | 0.87 | PPARG (1.00) | PPARGALDH1A1MAPTMAPK1USP2 | |
| 5-Demethylnobiletin SCHEMBL31237479 | 0.86 | ALDH1A1 (1.00) | PPARGALDH1A1MAPTMAPK1USP2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022202961-A1 | METHOD FOR PRODUCING DEMETHYLATED COMPOUND | 株式会社ダイセル | 2022-09-29 | — | — | WO | disclosed |