Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 3/20 | 0.50 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.50 |
| ▸ | PDE4A | P27815 | 2/20 | 0.50 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.50 |
| ▸ | GPR119 | Q8TDV5 | 7/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KDM1A | O60341 | 1/20 | 0.47 |
| ▸ | EED | O75530 | 1/20 | 0.47 |
| ▸ | RBBP4 | Q09028 | 1/20 | 0.47 |
| ▸ | SUZ12 | Q15022 | 1/20 | 0.47 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.47 |
| ▸ | AEBP2 | Q6ZN18 | 1/20 | 0.47 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.45 |
| ▸ | STS | P08842 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL15028316 | 0.88 | PDE4B (0.49) | PDE4BPDE4DPDE4APDE4CGPR119 | |
| SCHEMBL7486842 | 0.82 | ALDH1A1 (0.60) | ALDH1A1EEDRBBP4SUZ12EZH2 | |
| SCHEMBL2424923 | 0.81 | ALDH1A1 (0.50) | GPR119ALDH1A1EEDRBBP4SUZ12 | |
| SCHEMBL31078515 | 0.80 | PDE4B (0.48) | PDE4BPDE4DPDE4APDE4CGPR119 | |
| SCHEMBL31078714 | 0.80 | PDE4B (0.48) | PDE4BPDE4DPDE4APDE4CGPR119 | |
| SCHEMBL16296065 | 0.79 | KDM1A (0.53) | PDE4BPDE4DPDE4APDE4CGPR119 | |
| SCHEMBL3158355 | 0.78 | PDE4B (0.49) | PDE4BPDE4DPDE4APDE4CGPR119 | |
| SCHEMBL13060447 | 0.78 | PDE4D (0.49) | PDE4BPDE4DPDE4APDE4CGPR119 | |
| SCHEMBL3898794 | 0.78 | ALDH1A1 (0.46) | PDE4BALDH1A1 | |
| SCHEMBL3151620 | 0.78 | STS (0.55) | PDE4BPDE4DPDE4APDE4CGPR119 |
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-2013083991-A1 | NOVEL COMPOUNDS AND THEIR USE IN THERAPY | IMPERIAL INNOVATIONS LIMITED (GB) | 2013-06-13 | — | — | WO | disclosed |