Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 14/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 14/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 2/20 | 0.34 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.34 |
| ▸ | KIT | P10721 | 1/20 | 0.34 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | BRAF | P15056 | 1/20 | 0.34 |
| ▸ | TEK | Q02763 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30542646 | 1.00 | PDE4B (0.48) | PDE4BPDE4DKDM4EDYRK1ADYRK1B | |
| SCHEMBL29056268 | 0.90 | PDE4B (0.54) | PDE4BPDE4DKDM4EKDRBRAF | |
| SCHEMBL29056274 | 0.86 | PDE4B (0.53) | PDE4BPDE4DCYP2C9CYP2C19KDR | |
| SCHEMBL30542663 | 0.84 | PDE4B (0.56) | PDE4BPDE4DKDRBRAF | |
| SCHEMBL29056216 | 0.84 | PDE4B (0.56) | PDE4BPDE4DKDRBRAF | |
| SCHEMBL29056239 | 0.83 | SLC22A12 (0.45) | PDE4BPDE4DKDM4EUSP2CYP3A4 | |
| SCHEMBL30542634 | 0.80 | PDE4B (0.47) | PDE4BPDE4DKDM4EDYRK1ADYRK1B | |
| SCHEMBL29056287 | 0.80 | PDE4B (0.47) | PDE4BPDE4DKDM4EDYRK1ADYRK1B | |
| SCHEMBL30542649 | 0.80 | PDE4B (0.47) | PDE4BPDE4DKDM4EDYRK1ADYRK1B | |
| SCHEMBL29056248 | 0.80 | PDE4B (0.40) | PDE4BKDM4EDYRK1ADYRK1BKDR |
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-116640095-A | Diaryl amine derivative containing aliphatic carboxyl and preparation method and application thereof | 山东大学 | 2023-08-25 | — | — | CN | disclosed |