Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.47 |
| ▸ | DRD4 | P21917 | 2/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 2/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 3/20 | 0.38 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 2/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.34 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.34 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.34 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17083894 | 0.72 | DRD2 (0.60) | DRD2DRD4DRD3KDM2BCNR1 | |
| Hydrochloric Acid SCHEMBL16986263 | 0.71 | DRD2 (0.59) | DRD2DRD4DRD3KDM2BCNR1 | |
| Hydrochloric Acid SCHEMBL16986261 | 0.71 | DRD2 (0.59) | DRD2DRD4DRD3KDM2BCNR1 | |
| SCHEMBL16986272 | 0.70 | DRD2 (0.58) | DRD2DRD4DRD3KDM2BCNR1 | |
| SCHEMBL16986269 | 0.70 | DRD2 (0.58) | DRD2DRD4DRD3KDM2BCNR1 | |
| SCHEMBL17083892 | 0.69 | MAP4K3 (0.48) | DRD2DRD4DRD3IDO1KDM2B | |
| SCHEMBL15830635 | 0.69 | DRD2 (0.50) | DRD2DRD4DRD3KDM2BCNR1 | |
| SCHEMBL1581846 | 0.69 | DRD2 (0.60) | DRD2DRD4DRD3KDM2BMAP3K7 | |
| SCHEMBL27940238 | 0.69 | IDO1 (0.38) | DRD2DRD4DRD3IDO1PDE4A | |
| Hydrochloric Acid SCHEMBL16986237 | 0.69 | MAP4K3 (0.47) | DRD2DRD4DRD3IDO1KDM2B |
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 |
|---|---|---|---|---|---|---|---|
| CN-103443100-B | The 6-Imidazopyrazines of the replacement of MPS-1 and TKK inhibitor is used as in the treatment of hyperproliferative disorders | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2016-03-23 | — | — | CN | disclosed |