Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EIF2AK3 | Q9NZJ5 | 8/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | EPHB4 | P54760 | 4/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.35 |
| ▸ | PRKDC | P78527 | 3/20 | 0.35 |
| ▸ | EGFR | P00533 | 3/20 | 0.35 |
| ▸ | ABL1 | P00519 | 2/20 | 0.35 |
| ▸ | HCK | P08631 | 2/20 | 0.35 |
| ▸ | SRC | P12931 | 2/20 | 0.35 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.35 |
| ▸ | MTOR | P42345 | 2/20 | 0.35 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.35 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31728860 | 0.81 | ALOX5AP (0.37) | EIF2AK3EPHB4PIK3CDPIK3CBPIK3CG | |
| SCHEMBL31728800 | 0.79 | CRHR1 (0.39) | EIF2AK3PDE5AEPHB4PIK3CDPIK3CB | |
| SCHEMBL31727952 | 0.79 | EIF2AK3 (0.42) | EIF2AK3PDE5AEPHB4PIK3CBPIK3CG | |
| SCHEMBL31728359 | 0.78 | EPHB4 (0.36) | EIF2AK3EPHB4PIK3CDPIK3CBPIK3CG | |
| SCHEMBL31728766 | 0.74 | PIK3CD (0.38) | EPHB4PIK3CDPIK3CBPIK3CGPRKDC | |
| SCHEMBL31729240 | 0.73 | PIK3CD (0.37) | EPHB4PIK3CDPIK3CBPIK3CGPRKDC | |
| SCHEMBL31728529 | 0.72 | SRC (0.39) | EIF2AK3PDE5AEPHB4PIK3CDPIK3CB | |
| SCHEMBL21245470 | 0.72 | ALDH1A1 (0.42) | SRCNUDT1 | |
| SCHEMBL31728534 | 0.71 | PDE5A (0.44) | PDE5AEPHB4PIK3CDPIK3CBPIK3CG | |
| SCHEMBL31728528 | 0.70 | IDO1 (0.36) | PIK3CDPIK3CBPIK3CGPRKDCPIK3CA |
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-2025235874-A1 | HETEROCYCLICS AS EGFR INHIBITORS | SCHRÖDINGER, INC. (US) | 2025-11-13 | — | — | WO | disclosed |