Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 10/20 | 0.79 |
| ▸ | DRD3 | P35462 | 8/20 | 0.79 |
| ▸ | DRD4 | P21917 | 3/20 | 0.79 |
| ▸ | DRD1 | P21728 | 3/20 | 0.79 |
| ▸ | HTR1A | P08908 | 1/20 | 0.79 |
| ▸ | DRD5 | P21918 | 1/20 | 0.79 |
| ▸ | HTR7 | P34969 | 1/20 | 0.79 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.79 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.67 |
| ▸ | THPO | P40225 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL2599184 | 1.00 | DRD2 (0.79) | DRD2DRD3DRD4DRD1HTR1A | |
| SCHEMBL11181368 | 0.90 | DRD2 (0.65) | DRD2DRD3DRD4DRD1HTR1A | |
| 5-Oh-Dpat SCHEMBL30201073 | 0.89 | DRD2 (1.00) | DRD2DRD3DRD4DRD1HTR1A | |
| 5-Oh-Dpat SCHEMBL17446178 | 0.89 | DRD2 (1.00) | DRD2DRD3DRD4DRD1HTR1A | |
| 5-Oh-Dpat SCHEMBL29420186 | 0.89 | DRD2 (1.00) | DRD2DRD3DRD4DRD1HTR1A | |
| 5-Oh-Dpat SCHEMBL5705486 | 0.89 | DRD2 (1.00) | DRD2DRD3DRD4DRD1HTR1A | |
| 5-Oh-Dpat SCHEMBL279021 | 0.89 | DRD2 (1.00) | DRD2DRD3DRD4DRD1HTR1A | |
| SCHEMBL21262950 | 0.86 | DRD2 (0.90) | DRD2DRD3DRD4DRD1HTR1A | |
| SCHEMBL21083262 | 0.86 | DRD2 (0.90) | DRD2DRD3DRD4DRD1HTR1A | |
| Hydrochloric Acid SCHEMBL7328010 | 0.85 | DRD2 (0.56) | DRD2DRD3DRD4DRD1HTR1A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011146610-A2 | AN ENANTIOSELECTIVE SYNTHESIS OF CHIRAL AMINES FOR THE PRODUCTION OF ROTIGOTINE | DR. REDDY'S LABORATORIES LTD. (IN) | 2011-11-24 | — | — | WO | claimed |
| WO-2011146610-A2 | AN ENANTIOSELECTIVE SYNTHESIS OF CHIRAL AMINES FOR THE PRODUCTION OF ROTIGOTINE | DR. REDDY'S LABORATORIES LTD. (IN) | 2011-11-24 | — | — | WO | disclosed |