Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL203219 | 0.89 | DRD2 (0.58) | MAPTKDM4ECA12CA1CA2 | |
| SCHEMBL5757595 | 0.86 | MAPT (0.42) | MAPTKDM4ECA12CA1CA2 | |
| SCHEMBL29722558 | 0.76 | DRD2 (0.78) | MAPTKDM4ECA12CA1CA2 | |
| SCHEMBL532839 | 0.76 | DRD2 (0.78) | MAPTKDM4ECA12CA1CA2 | |
| SCHEMBL29953543 | 0.74 | DRD2 (0.44) | MAPTCA1CA2ALDH1A1DRD2 | |
| SCHEMBL200682 | 0.74 | DRD2 (0.44) | MAPTCA1CA2ALDH1A1DRD2 | |
| SCHEMBL29956883 | 0.72 | ALDH1A1 (0.45) | CA12CA1CA2GAAALDH1A1 | |
| SCHEMBL442154 | 0.72 | ALDH1A1 (0.45) | CA12CA1CA2GAAALDH1A1 | |
| SCHEMBL4027923 | 0.72 | ADRA2A (0.42) | CA1CA2ALDH1A1ALOX15HSD17B10 | |
| SCHEMBL3362013 | 0.72 | CA12 (0.71) | MAPTKDM4ECA12CA1CA2 |
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-1874753-A2 | COMPOUNDS, COMPOSITIONS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006113432-A2 | COMPOUNDS, COMPOSITIONS AND METHODS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-10-26 | — | — | WO | disclosed |