Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | PDE4A | P27815 | 2/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.49 |
| ▸ | NISCH | Q9Y2I1 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | FASN | P49327 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | VCP | P55072 | 4/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.43 |
| ▸ | SMO | Q99835 | 1/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11826761 | 0.88 | ALDH1A1 (0.57) | KDM4EALDH1A1PDE4APDE4BPDE4C | |
| SCHEMBL3894639 | 0.83 | KDM4E (0.73) | KDM4EALDH1A1PDE4APDE4BPDE4C | |
| SCHEMBL5173656 | 0.78 | ALDH1A1 (0.64) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL29140743 | 0.77 | KDM4E (1.00) | KDM4EALDH1A1PDE4APDE4BPDE4C | |
| SCHEMBL7024684 | 0.76 | KDM4E (0.66) | KDM4EALDH1A1PDE4APDE4BPDE4C | |
| SCHEMBL5161099 | 0.76 | KDM4E (0.44) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL7861191 | 0.76 | KDM4E (0.57) | KDM4EALDH1A1PDE4APDE4BPDE4C | |
| SCHEMBL4270804 | 0.74 | MAPT (0.61) | KDM4EALDH1A1CYP1A2MEN1KMT2A | |
| SCHEMBL13516204 | 0.74 | KDM4E (0.43) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL7298838 | 0.74 | KDM4E (0.55) | KDM4EALDH1A1NISCHVCPMAPK14 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1317433-A2 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2003-06-11 | — | — | EP | disclosed |
| WO-2002020495-A2 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2002-03-14 | — | — | WO | disclosed |
| EP-1087963-A1 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | Chiron Corporation (US) | 2001-04-04 | — | — | EP | disclosed |
| WO-1999065897-A1 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 1999-12-23 | — | — | WO | disclosed |