Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.65 |
| ▸ | SRC | P12931 | 1/20 | 0.65 |
| ▸ | KDR | P35968 | 1/20 | 0.65 |
| ▸ | PI4KA | P42356 | 3/20 | 0.56 |
| ▸ | PI4K2B | Q8TCG2 | 3/20 | 0.56 |
| ▸ | PI4K2A | Q9BTU6 | 3/20 | 0.56 |
| ▸ | PI4KB | Q9UBF8 | 3/20 | 0.56 |
| ▸ | F7 | P08709 | 1/20 | 0.56 |
| ▸ | F3 | P13726 | 1/20 | 0.56 |
| ▸ | SARM1 | Q6SZW1 | 1/20 | 0.56 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.56 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.56 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.56 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.56 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.56 |
| ▸ | SIRT4 | Q9Y6E7 | 1/20 | 0.56 |
| ▸ | CHKA | P35790 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Niacinamide SCHEMBL28597484 | 0.89 | EGFR (0.61) | EGFRSRCKDRPI4KAPI4K2B | |
| Niacinamide SCHEMBL23531100 | 0.89 | EGFR (0.61) | EGFRSRCKDRPI4KAPI4K2B | |
| Niacinamide SCHEMBL27560268 | 0.86 | EGFR (0.78) | EGFRSRCKDRPI4KAPI4K2B | |
| SCHEMBL21066915 | 0.82 | EGFR (0.65) | EGFRSRCKDRPI4KAPI4K2B | |
| Niacinamide SCHEMBL28275359 | 0.81 | EGFR (0.53) | EGFRSRCKDRPI4KAPI4K2B | |
| Niacinamide SCHEMBL27733580 | 0.80 | EGFR (0.52) | EGFRSRCKDRPI4KAPI4K2B | |
| SCHEMBL3802976 | 0.79 | EGFR (0.61) | EGFRSRCKDRPI4KAPI4K2B | |
| SCHEMBL1271540 | 0.79 | EGFR (0.61) | EGFRSRCKDRPI4KAPI4K2B | |
| Adenine SCHEMBL22748483 | 0.77 | F7 (0.56) | EGFRSRCKDRPI4KAPI4K2B | |
| Adenine SCHEMBL15699 | 0.77 | F7 (0.56) | EGFRSRCKDRPI4KAPI4K2B |
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-4143181-A1 | 1-PYRAZINYLPYRAZOLYL-3-OXYALKYL ACIDS AND THEIR DERIVATIVES, AND THEIR USE FOR CONTROL OF UNDESIRED PLANT GROWTH | Bayer Aktiengesellschaft (DE) | 2023-03-08 | — | — | EP | disclosed |
| WO-2020245044-A1 | 1-PHENYL-5-AZINYL PYRAZOLYL-3-OXYALKYL ACIDS AND THEIR USE FOR CONTROLLING UNDESIRED PLANT GROWTH | BAYER AKTIENGESELLSCHAFT (DE) | 2020-12-10 | — | — | WO | disclosed |