Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.46 |
| ▸ | DRD4 | P21917 | 4/20 | 0.46 |
| ▸ | DRD3 | P35462 | 4/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.42 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TACR2 | P21452 | 1/20 | 0.42 |
| ▸ | TACR1 | P25103 | 1/20 | 0.42 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1975431 | 1.00 | DRD2 (0.46) | DRD2DRD4DRD3SIGMAR1SLC6A3 | |
| SCHEMBL1975660 | 0.90 | PDE4B (0.48) | DRD2DRD4DRD3SIGMAR1SLC6A3 | |
| SCHEMBL1984850 | 0.90 | PDE4B (0.48) | DRD2DRD4DRD3SIGMAR1SLC6A3 | |
| SCHEMBL1984852 | 0.90 | PDE4B (0.48) | DRD2DRD4DRD3SIGMAR1SLC6A3 | |
| SCHEMBL1421566 | 0.89 | SIGMAR1 (0.47) | DRD2DRD4DRD3SIGMAR1SLC6A3 | |
| SCHEMBL1421571 | 0.89 | SIGMAR1 (0.47) | DRD2DRD4DRD3SIGMAR1SLC6A3 | |
| SCHEMBL1977236 | 0.88 | RORC (0.46) | DRD2DRD4DRD3SIGMAR1RORC | |
| SCHEMBL2225981 | 0.88 | RORC (0.46) | DRD2DRD4DRD3SIGMAR1RORC | |
| SCHEMBL1976032 | 0.83 | SIGMAR1 (0.47) | DRD2DRD3SIGMAR1SLC6A3SLC6A2 | |
| SCHEMBL2225316 | 0.83 | SIGMAR1 (0.47) | DRD2DRD3SIGMAR1SLC6A3SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2513052-A1 | PYRROLIDINE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011085886-A1 | PYRROLIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-07-21 | — | — | WO | disclosed |