Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | CASP1 | P29466 | 2/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL23958986 | 0.87 | BCHE (0.40) | PDE4APDE4BPDE4CPDE4DBCHE | |
| SCHEMBL23959024 | 0.85 | PDE4A (0.42) | PDE4APDE4BPDE4CPDE4DBCHE | |
| SCHEMBL23959128 | 0.84 | PDE4A (0.40) | PDE4APDE4BPDE4CPDE4DBCHE | |
| SCHEMBL23959065 | 0.84 | PDE4A (0.40) | PDE4APDE4BPDE4CPDE4DBCHE | |
| SCHEMBL23959419 | 0.82 | PDE4A (0.39) | PDE4APDE4BPDE4CPDE4DBCHE | |
| SCHEMBL23958995 | 0.82 | BCHE (0.42) | PDE4APDE4BPDE4CPDE4DBCHE | |
| SCHEMBL23959140 | 0.79 | PDE4A (0.36) | PDE4APDE4BPDE4CPDE4DBCHE | |
| SCHEMBL23959081 | 0.79 | CASP1 (0.39) | PDE4APDE4BPDE4CPDE4DBCHE | |
| SCHEMBL23959108 | 0.79 | CASP1 (0.39) | PDE4APDE4BPDE4CPDE4DBCHE | |
| SCHEMBL23959047 | 0.75 | PDE4A (0.45) | PDE4APDE4BPDE4CPDE4DBCHE |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021212974-A1 | RACEMIC AND CHIRAL 3-(2,3-BUTADIENYL)OXYINDOLINONE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 复旦大学 (CN) | 2021-10-28 | — | — | WO | disclosed |