Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 6/20 | 0.46 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.41 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 4/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | DRD5 | P21918 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | TNF | P01375 | 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 | |
|---|---|---|---|---|
| SCHEMBL17898231 | 0.78 | DRD3 (0.60) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL13448958 | 0.73 | DRD3 (0.67) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL13448986 | 0.72 | DRD2 (0.57) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL13448974 | 0.71 | DRD2 (0.76) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL13448977 | 0.69 | DRD2 (0.71) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL25761822 | 0.68 | ADAM17 (0.56) | DRD2ADAM17DRD3DRD5HTR7 | |
| SCHEMBL7943382 | 0.68 | ADAM17 (0.60) | ADAM17TNF | |
| SCHEMBL5207129 | 0.68 | HTR1A (0.60) | DRD2DRD3DRD5HTR7HTR1A | |
| SCHEMBL13448959 | 0.67 | DRD2 (0.66) | DRD2DRD4DRD3DRD1DRD5 | |
| SCHEMBL7940833 | 0.67 | ADAM17 (0.58) | ADAM17TNF |
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 |
|---|---|---|---|---|---|---|---|
| US-20120265514-A1 | DESIGN OF MOLECULES | UNIVERSITY OF DUNDEE (GB) | 2012-10-18 | — | — | US | disclosed |
| US-20120265514-A1 | DESIGN OF MOLECULES | UNIVERSITY OF DUNDEE (GB) | 2012-10-18 | — | — | US | disclosed |