Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 6/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7449308 | 0.70 | DRD3 (0.42) | DRD3DRD2DRD4HTR1AFYN | |
| SCHEMBL7364201 | 0.68 | CYP1A2 (0.31) | — | |
| SCHEMBL7198979 | 0.67 | CYP19A1 (0.38) | — | |
| SCHEMBL9480647 | 0.66 | MAPT (0.32) | — | |
| SCHEMBL15161167 | 0.66 | — | — | |
| SCHEMBL7446300 | 0.66 | DRD3 (0.41) | DRD3DRD2DRD4HTR1AFYN | |
| SCHEMBL7446759 | 0.63 | DRD3 (0.38) | DRD3DRD2DRD4HTR1AFYN | |
| SCHEMBL10394276 | 0.62 | CYP19A1 (0.39) | — | |
| SCHEMBL16599788 | 0.62 | — | — | |
| SCHEMBL901128 | 0.62 | ESR2 (0.31) | — |
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-2001028977-A1 | METHOD FOR TREATING PARKINSON'S DISEASE BY ADMINISTERING (-)-5-KETO-2-N,N-DI-N-PROPYLAMINO-TETRAHYDROTETRALIN | WARNER-LAMBERT COMPANY (US) | 2001-04-26 | — | — | WO | disclosed |