Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.54 |
| ▸ | BACE1 | P56817 | 3/20 | 0.54 |
| ▸ | AURKA | O14965 | 3/20 | 0.53 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.53 |
| ▸ | KIT | P10721 | 2/20 | 0.53 |
| ▸ | KDM1A | O60341 | 1/20 | 0.52 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.51 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4725054 | 0.99 | ACHE (0.55) | ACHEBACE1AURKAPDE3AKIT | |
| SCHEMBL4725230 | 0.97 | ACHE (0.55) | ACHEBACE1AURKAPDE3AKIT | |
| SCHEMBL4729973 | 0.91 | PDE10A (0.64) | ACHEBACE1AURKAKITKDM1A | |
| SCHEMBL4725590 | 0.86 | PDE3A (0.75) | PDE3APDE10A | |
| SCHEMBL4727792 | 0.82 | PDE3A (0.73) | PDE3APDE10A | |
| SCHEMBL4728977 | 0.79 | PDE10A (0.47) | KITKDM1APDE10A | |
| SCHEMBL4725127 | 0.79 | CSF1R (0.51) | PDE10APDGFRB | |
| SCHEMBL4728469 | 0.79 | PDE10A (0.47) | KITKDM1APDE10A | |
| SCHEMBL5518977 | 0.79 | ACHE (0.76) | ACHEBACE1AURKAPDE3APDE10A | |
| SCHEMBL4725096 | 0.78 | PDE3A (0.77) | ACHEBACE1PDE3APDE10A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008020302-A2 | HETEROAROMATIC QUINOLINE-BASED COMPOUNDS AS PHOSPHODIESTERASE (PDE) INHIBITORS | PFIZER PRODUCTS INC. (US) | 2008-02-21 | — | — | WO | claimed |
| WO-2008020302-A2 | HETEROAROMATIC QUINOLINE-BASED COMPOUNDS AS PHOSPHODIESTERASE (PDE) INHIBITORS | PFIZER PRODUCTS INC. (US) | 2008-02-21 | — | — | WO | disclosed |