Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.34 |
| ▸ | CCR4 | P51679 | 1/20 | 0.33 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 3/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 3/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PI4KA | P42356 | 1/20 | 0.32 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.32 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.32 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.32 |
| ▸ | BCL2 | P10415 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | ADK | P55263 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31728359 | 0.80 | EPHB4 (0.36) | IDO1PDPK1CCR4ALDH1A1PDCD1 | |
| SCHEMBL31727897 | 0.77 | LIMK1 (0.36) | IDO1MAP4K4LIMK1ALDH1A1TGFBR1 | |
| SCHEMBL31729241 | 0.72 | IDO1 (0.36) | IDO1MAP4K4LIMK1ALDH1A1PIK3CD | |
| SCHEMBL31728528 | 0.72 | IDO1 (0.36) | IDO1MAP4K4ALDH1A1TGFBR1PIK3CD | |
| SCHEMBL31728529 | 0.71 | SRC (0.39) | PDE5APDPK1MAP4K4LIMK1PIK3CD | |
| SCHEMBL31728800 | 0.71 | CRHR1 (0.39) | PDE5APDPK1MAP4K4LIMK1PIK3CD | |
| SCHEMBL31728484 | 0.70 | PDE5A (0.46) | PDE5AMAP4K4LIMK1ALDH1A1ADK | |
| SCHEMBL31728623 | 0.69 | SMN1; SMN2 (0.39) | PDE5AIDO1MAP4K4LIMK1ALDH1A1 | |
| SCHEMBL31728620 | 0.69 | IDO1 (0.38) | IDO1CCR4ALDH1A1PDCD1CD274 | |
| SCHEMBL31728766 | 0.69 | PIK3CD (0.38) | IDO1LIMK1ALDH1A1PIK3CDPIK3CA |
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 |