Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 1/20 | 0.59 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.52 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.51 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.48 |
| ▸ | MAOB | P27338 | 3/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | RXRA | P19793 | 1/20 | 0.46 |
| ▸ | RXRB | P28702 | 1/20 | 0.46 |
| ▸ | RXRG | P48443 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28506911 | 0.90 | FFAR1 (0.57) | PDE4DALOX5FFAR1PDE4BMAOB | |
| SCHEMBL28511398 | 0.89 | PDE4D (0.59) | PDE4DALOX5FFAR1PDE4BMAOB | |
| SCHEMBL28525205 | 0.87 | PDE4B (0.50) | PDE4DALOX5FFAR1PDE4BMAOB | |
| SCHEMBL28509052 | 0.86 | RXRA (0.65) | PDE4DFFAR1PDE4BMAOBMAOA | |
| SCHEMBL28906912 | 0.84 | PDE4D (0.58) | PDE4DFFAR1PDE4BMAOBMAOA | |
| SCHEMBL28510358 | 0.82 | FFAR1 (0.53) | PDE4DALOX5FFAR1PDE4BMAOB | |
| SCHEMBL28509464 | 0.82 | FFAR1 (0.50) | ALOX5FFAR1 | |
| SCHEMBL28509465 | 0.81 | NR4A2 (0.65) | PDE4DMAOBMAOARXRARXRB | |
| SCHEMBL28509059 | 0.81 | PDE4B (0.49) | PDE4DFFAR1PDE4BMAOB | |
| SCHEMBL28509466 | 0.80 | PDE4D (0.55) | PDE4DPDE4BMAOBMAOARXRA |
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 |
|---|---|---|---|---|---|---|---|
| CN-108997122-B | 3-aryl-4-alkoxy benzyl ether derivative and preparation method and application thereof | 南方医科大学 | 2020-12-29 | — | — | CN | claimed |
| CN-108997122-B | 3-aryl-4-alkoxy benzyl ether derivative and preparation method and application thereof | 南方医科大学 | 2020-12-29 | — | — | CN | disclosed |