Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 6/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 6/20 | 0.50 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 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 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.34 |
| ▸ | VCP | P55072 | 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 | |
|---|---|---|---|---|
| SCHEMBL29056205 | 1.00 | PDE4B (0.50) | PDE4BPDE4DSYKEGFRKDR | |
| SCHEMBL29056263 | 0.85 | PDE4B (0.50) | PDE4BPDE4DSYKEGFRKDR | |
| SCHEMBL30542625 | 0.85 | PDE4B (0.50) | PDE4BPDE4DSYKEGFRKDR | |
| SCHEMBL31469083 | 0.80 | PDE4B (0.47) | PDE4BPDE4D | |
| SCHEMBL29056217 | 0.76 | SYK (0.40) | PDE4BPDE4DSYKEGFRKDR | |
| SCHEMBL29056216 | 0.76 | PDE4B (0.56) | PDE4BPDE4DKDR | |
| SCHEMBL30542663 | 0.76 | PDE4B (0.56) | PDE4BPDE4DKDR | |
| SCHEMBL29056207 | 0.74 | PDE4B (0.50) | PDE4BPDE4DSYKKDM4E | |
| SCHEMBL30542629 | 0.74 | PDE4B (0.50) | PDE4BPDE4DKDM4E | |
| SCHEMBL31469077 | 0.73 | SYK (0.41) | SYKEGFRABCG2GSK3BCYP3A4 |
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 |