Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 12/20 | 0.45 |
| ▸ | PDE4B | Q07343 | 9/20 | 0.45 |
| ▸ | PDE4A | P27815 | 7/20 | 0.45 |
| ▸ | PDE4C | Q08493 | 7/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.44 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.43 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.39 |
| ▸ | KRAS | P01116 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29059331 | 1.00 | PDE4D (0.45) | PDE4DPDE4BPDE4APDE4CERBB2 | |
| SCHEMBL29059335 | 1.00 | PDE4D (0.45) | PDE4DPDE4BPDE4APDE4CERBB2 | |
| SCHEMBL29058957 | 0.80 | PDE4D (0.45) | PDE4DPDE4BPDE4APDE4CERBB2 | |
| SCHEMBL30544671 | 0.80 | PDE4D (0.45) | PDE4DPDE4BPDE4APDE4CERBB2 | |
| SCHEMBL29058960 | 0.80 | PDE4D (0.45) | PDE4DPDE4BPDE4APDE4CERBB2 | |
| SCHEMBL29058595 | 0.79 | ERBB2 (0.46) | PDE4DPDE4BPDE4APDE4CERBB2 | |
| SCHEMBL29058592 | 0.79 | ERBB2 (0.46) | PDE4DPDE4BPDE4APDE4CERBB2 | |
| SCHEMBL30544691 | 0.79 | ERBB2 (0.46) | PDE4DPDE4BPDE4APDE4CERBB2 | |
| SCHEMBL29940132 | 0.78 | ALDH1A1 (0.63) | PDE4DPDE4BPDE4APDE4CERBB2 | |
| SCHEMBL23520707 | 0.74 | SOS1 (0.47) | PDE4DPDE4BPDE4APDE4CERBB2 |
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-116635371-A | Polycyclic pyridazinone derivative serving as SOS1 inhibitor, and preparation method and application thereof | 苏州阿尔脉生物科技有限公司 | 2023-08-22 | — | — | CN | disclosed |