Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.31 |
| ▸ | MELK | Q14680 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21494203 | 0.81 | EGFR (0.33) | EGFRMELK | |
| SCHEMBL23020432 | 0.75 | KCNH2 (0.34) | EGFRMELK | |
| SCHEMBL3379185 | 0.75 | MAP4K4 (0.41) | PIK3CDEGFRPIK3CAMAPTMAP4K4 | |
| SCHEMBL30775555 | 0.75 | MAP4K4 (0.41) | PIK3CDEGFRPIK3CAMAPTMAP4K4 | |
| SCHEMBL16748191 | 0.72 | MAPT (0.40) | MAPT | |
| SCHEMBL9955167 | 0.70 | ALDH1A1 (0.41) | PIK3CA | |
| SCHEMBL29439641 | 0.68 | MAP4K4 (0.54) | MAP4K4 | |
| SCHEMBL22715644 | 0.68 | NR4A2 (0.47) | PIK3CDEGFRMAPT | |
| SCHEMBL15587364 | 0.68 | MAP4K4 (0.54) | MAP4K4 | |
| SCHEMBL21914082 | 0.68 | PIK3CD (0.33) | PIK3CDEGFR |
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-117500803-A | Amino-substituted heterocycles for the treatment of cancers with EGFR mutations | 纽威伦特公司 | 2024-02-02 | — | — | CN | disclosed |