Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 6/20 | 0.34 |
| ▸ | PIK3CG | P48736 | 6/20 | 0.34 |
| ▸ | PIK3CB | P42338 | 5/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 2/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.34 |
| ▸ | KDR | P35968 | 2/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
| ▸ | CCNC | P24863 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL24309468 | 1.00 | HRH3 (0.37) | HRH3GRM5PIK3CDPIK3CGPIK3CB | |
| SCHEMBL26810272 | 0.89 | EGFR (0.38) | EGFRFGFR1KDRAURKAAURKB | |
| SCHEMBL29566346 | 0.88 | HTR1A (0.36) | PIK3CDPIK3CGPIK3CBMTOREGFR | |
| SCHEMBL24309393 | 0.88 | HTR1A (0.36) | PIK3CDPIK3CGPIK3CBMTOREGFR | |
| SCHEMBL26810187 | 0.87 | SLC6A9 (0.38) | PIK3CDPIK3CGPIK3CBEGFRFGFR1 | |
| SCHEMBL29567200 | 0.87 | F10 (0.43) | EGFRFGFR1KDRSMN1; SMN2 | |
| SCHEMBL24310795 | 0.87 | F10 (0.43) | EGFRFGFR1KDRSMN1; SMN2 | |
| SCHEMBL26814536 | 0.87 | PIK3CD (0.36) | PIK3CDPIK3CGPIK3CBMTORTSHR | |
| SCHEMBL24309639 | 0.86 | HRH3 (0.41) | HRH3EGFRFGFR1KDRSCN9A | |
| SCHEMBL29566701 | 0.86 | HRH3 (0.41) | HRH3EGFRFGFR1KDRSCN9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4225748-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |