Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.47 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.47 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.47 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 2/20 | 0.47 |
| ▸ | DRD3 | P35462 | 2/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.43 |
| ▸ | OXTR | P30559 | 2/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | GPR183 | P32249 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | FASN | P49327 | 1/20 | 0.40 |
| ▸ | BPTF | Q12830 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3386743 | 0.95 | DRD2 (0.48) | PDK1PDK2PDK3PDK4DRD2 | |
| SCHEMBL3387478 | 0.91 | HRH3 (0.51) | HRH3OXTRCNR2BPTFSLC6A4 | |
| SCHEMBL3388425 | 0.85 | HRH3 (0.52) | DRD2DRD3MAPK14HRH3CHRM2 | |
| SCHEMBL3391336 | 0.85 | HRH3 (0.53) | HRH3OXTRSLC6A4 | |
| SCHEMBL3388732 | 0.85 | MAPK14 (0.44) | DRD2DRD3MAPK14HRH3CHRM2 | |
| SCHEMBL2219560 | 0.81 | MAPK14 (0.60) | DRD2DRD3MAPK14HRH3CHRM2 | |
| SCHEMBL18941317 | 0.80 | OXTR (0.49) | PDK1PDK2PDK3PDK4DRD2 | |
| SCHEMBL3387602 | 0.77 | HRH3 (0.54) | HRH3CNR2 | |
| SCHEMBL3388360 | 0.77 | HRH3 (0.43) | DRD2DRD3MAPK14HRH3CHRM2 | |
| SCHEMBL3389514 | 0.75 | HRH3 (0.55) | HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2029534-B1 | 1H-INDOL-5-YL-PIPERAZIN-1-YL-METHANONE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2010-12-22 | — | — | EP | disclosed |