Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR4A2 | P43354 | 1/20 | 0.50 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.50 |
| ▸ | AXL | P30530 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | AR | P10275 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | KDM6B | O15054 | 1/20 | 0.42 |
| ▸ | KDM5C | P41229 | 1/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.42 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.42 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.41 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.41 |
| ▸ | HPGDS | O60760 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30800091 | 0.93 | ALDH1A1 (0.54) | CYP46A1ALDH1A1ARMAPK1KDM4E | |
| SCHEMBL29735406 | 0.88 | ALDH1A1 (0.51) | NR4A2AXLALDH1A1KDM4EGAA | |
| SCHEMBL3712306 | 0.88 | ALDH1A1 (0.51) | NR4A2AXLALDH1A1KDM4EGAA | |
| SCHEMBL13188268 | 0.86 | EGFR (0.51) | NR4A2AXLALDH1A1GAAHDAC1 | |
| SCHEMBL14210410 | 0.86 | FDPS (0.48) | NR4A2CYP46A1ALDH1A1ARMAPK1 | |
| SCHEMBL2958040 | 0.85 | SLC6A4 (0.46) | ALDH1A1KDM4EGAA | |
| SCHEMBL13188759 | 0.85 | DYRK1A (0.58) | ALDH1A1KDM4EGAA | |
| SCHEMBL27237665 | 0.85 | ALDH1A1 (0.52) | ALDH1A1KDM4E | |
| SCHEMBL13545747 | 0.83 | KDM4E (0.53) | ALDH1A1MAPK1KDM4EKDM6BKDM5C | |
| SCHEMBL3712320 | 0.82 | CYP19A1 (0.60) | NR4A2ALDH1A1NEK1 |
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-111378144-A | Force-induced response supramolecular polymer | 翁秋梅 | 2020-07-07 | — | — | CN | disclosed |