Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 14/20 | 0.75 |
| ▸ | PIK3CG | P48736 | 4/20 | 0.68 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.68 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.68 |
| ▸ | EGFR | P00533 | 3/20 | 0.65 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.54 |
| ▸ | PI4KA | P42356 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL29133751 | 0.88 | EGFR (0.68) | PIK3CAPIK3CGPIK3CDPIK3CBEGFR | |
| SCHEMBL27170398 | 0.87 | EGFR (0.84) | PIK3CAPIK3CGPIK3CDPIK3CBEGFR | |
| SCHEMBL29133727 | 0.85 | PIK3CA (0.65) | PIK3CAEGFRALDH1A1LMNACYP1A2 | |
| SCHEMBL29133708 | 0.83 | EGFR (0.82) | PIK3CAEGFRALDH1A1LMNACYP1A2 | |
| SCHEMBL24576803 | 0.82 | PIK3CA (0.77) | PIK3CAPIK3CGPIK3CDPIK3CBEGFR | |
| SCHEMBL24576531 | 0.79 | EGFR (1.00) | PIK3CAPIK3CDEGFRALDH1A1LMNA | |
| SCHEMBL27170399 | 0.79 | EGFR (0.70) | PIK3CAPIK3CGPIK3CDPIK3CBEGFR | |
| SCHEMBL17845959 | 0.78 | PIK3CA (0.66) | PIK3CAPIK3CGPIK3CDPIK3CBEGFR | |
| SCHEMBL29667014 | 0.78 | PIK3CA (0.66) | PIK3CAPIK3CGPIK3CDPIK3CBEGFR | |
| SCHEMBL29133765 | 0.78 | EGFR (0.54) | PIK3CAPIK3CDEGFRPIK3R1ALDH1A1 |
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-117295716-A | Substituted aminobenzyl heteroaryl compounds as EGFR and/or PI3K inhibitors | 麦克尼斯迪克治疗有限公司 | 2023-12-26 | — | — | CN | disclosed |