Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9827678 | 0.76 | CYP2D6 (0.41) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL10812563 | 0.76 | CYP2D6 (0.37) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL1269231 | 0.74 | MAPK1 (0.39) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL5181484 | 0.73 | KCNN4 (0.36) | OPRM1ALDH1A1 | |
| SCHEMBL9435995 | 0.72 | CYP2D6 (0.44) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL3118068 | 0.68 | MAPK1 (0.42) | CYP3A4MAPK1ALDH1A1ALOX15 | |
| SCHEMBL4629554 | 0.68 | MAPK1 (0.42) | CYP3A4MAPK1ALDH1A1ALOX15 | |
| SCHEMBL7041483 | 0.67 | MAPK1 (0.38) | CYP3A4MAPK1ALDH1A1ALOX15 | |
| SCHEMBL13785278 | 0.67 | ALDH1A1 (0.38) | CYP2D6DRD2DRD4OPRM1DRD3 | |
| SCHEMBL10605210 | 0.67 | MAPK1 (0.39) | CYP2D6DRD2DRD4OPRM1DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| US-7414078-B2 | Oral general anesthetics and metabolitically resistant anticonvulsants | UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) | 2008-08-19 | — | — | US | disclosed |