Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
| ▸ | DRD4 | P21917 | 3/20 | 0.43 |
| ▸ | DRD3 | P35462 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | WDR5 | P61964 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2474020 | 0.85 | KDM4E (0.60) | KDM4ECYP1A2CYP2D6CYP2C19MEN1 | |
| SCHEMBL2467576 | 0.81 | KDM4E (0.79) | KDM4ECYP1A2CYP2D6CYP2C19MEN1 | |
| SCHEMBL5562491 | 0.81 | ATF4 (0.54) | KDM4E | |
| SCHEMBL2471205 | 0.80 | KMT2A (0.50) | KDM4EMEN1KMT2ADRD2DRD4 | |
| SCHEMBL1824874 | 0.80 | MEN1 (0.43) | MEN1KMT2ADRD2DRD4DRD3 | |
| SCHEMBL2473347 | 0.79 | KMT2A (0.48) | KDM4EMEN1KMT2ADRD2DRD4 | |
| SCHEMBL13980799 | 0.75 | KDM4E (0.68) | KDM4ECYP1A2CYP2D6CYP2C19MEN1 | |
| SCHEMBL23074658 | 0.74 | KDM4E (0.88) | KDM4ECYP1A2CYP2D6CYP2C19MEN1 | |
| SCHEMBL23074654 | 0.74 | KDM4E (0.88) | KDM4ECYP1A2CYP2D6CYP2C19MEN1 | |
| SCHEMBL14097162 | 0.73 | DRD2 (0.50) | KDM4EDRD2DRD4DRD3WDR5 |
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-2004105762-A1 | MEDICAL USE OF DIAZABICYCLONONENE DERIVATIVES AS INHIBITORS OF PARASITE ASPARTIC PROTEASES | ACTELION PHARMACEUTICALS LTD (CH) | 2004-12-09 | — | — | WO | disclosed |