Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8529985 | 0.81 | DRD2 (0.50) | DRD2DRD4ALDH1A1GAAMAPT | |
| SCHEMBL11524478 | 0.78 | DRD2 (0.47) | DRD2DRD4ALDH1A1GAAMAPT | |
| SCHEMBL395752 | 0.77 | DRD2 (0.53) | DRD2DRD4ALDH1A1GAAMAPT | |
| SCHEMBL27610237 | 0.77 | DRD2 (0.46) | DRD2DRD4ALDH1A1GAAMAPT | |
| SCHEMBL18522328 | 0.77 | KDM4E (0.50) | DRD2DRD4ALDH1A1GAAMAPT | |
| SCHEMBL11966014 | 0.76 | DRD2 (0.49) | DRD2DRD4ALDH1A1GAAMAPT | |
| SCHEMBL565857 | 0.76 | DRD2 (0.45) | DRD2DRD4ALDH1A1KDM4ELMNA | |
| SCHEMBL5536336 | 0.74 | DRD2 (0.50) | DRD2DRD4ALDH1A1GAAMAPT | |
| SCHEMBL27388262 | 0.74 | DRD2 (0.46) | DRD2DRD4ALDH1A1MAPTALOX15 | |
| SCHEMBL12324805 | 0.73 | DRD2 (0.57) | DRD2DRD4ALDH1A1GAAMAPT |
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-7851658-B2 | Palladium-catalyzed carbon-carbon bond forming reactions | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2010-12-14 | — | — | US | disclosed |