Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | CCR8 | P51685 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | STS | P08842 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | NCEH1 | Q6PIU2 | 2/20 | 0.42 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5533679 | 0.89 | ACHE (0.46) | ACHEKDM4EPKMALDH1A1GPR119 | |
| SCHEMBL69077 | 0.83 | KDM4E (0.50) | KDM4EPKMALDH1A1GPR119CCR8 | |
| SCHEMBL69764 | 0.78 | MAPT (0.54) | KDM4EPKMALDH1A1GPR119NPC1 | |
| SCHEMBL31184445 | 0.78 | KDM4E (0.53) | KDM4EPKMALDH1A1GPR119CCR8 | |
| SCHEMBL2604335 | 0.78 | KDM4E (0.53) | KDM4EPKMALDH1A1GPR119CCR8 | |
| SCHEMBL616004 | 0.78 | STS (0.60) | ACHEKDM4EPKMALDH1A1GPR119 | |
| SCHEMBL4200062 | 0.78 | MEN1 (0.57) | ACHEKDM4EPKMALDH1A1GPR119 | |
| SCHEMBL5992995 | 0.78 | EPHX2 (0.56) | KDM4EPKMALDH1A1GPR119NPC1 | |
| SCHEMBL5013239 | 0.76 | ALDH1A1 (0.51) | KDM4EPKMALDH1A1GPR119NPC1 | |
| SCHEMBL20766458 | 0.75 | GPR119 (0.52) | KDM4EPKMALDH1A1GPR119NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1828122-A2 | N-PYRROLIDIN-3-YL-AMIDE DERIVATIVES AS SEROTONIN AND NORADRENALIN RE-UPTAKE INHIBITORS | Pfizer Limited (GB) | 2007-09-05 | — | — | EP | disclosed |
| WO-2006064351-A2 | N-PYRROLIDIN-3-YL-AMIDE DERIVATIVES AS SEROTONIN AND NORADRENALIN RE-UPTAKE INHIBITORS | PFIZER LIMITED (GB) | 2006-06-22 | — | — | WO | disclosed |