Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 13/20 | 0.54 |
| ▸ | CA1 | P00915 | 13/20 | 0.54 |
| ▸ | CA2 | P00918 | 13/20 | 0.54 |
| ▸ | CA9 | Q16790 | 13/20 | 0.54 |
| ▸ | THRB | P10828 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 7/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | FYN | P06241 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | PRKCA | P17252 | 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 | |
|---|---|---|---|---|
| SCHEMBL4616952 | 1.00 | CA12 (0.54) | CA12CA1CA2CA9THRB | |
| SCHEMBL4616897 | 0.90 | CA12 (0.52) | CA12CA1CA2CA9THRB | |
| SCHEMBL4616902 | 0.90 | CA12 (0.52) | CA12CA1CA2CA9THRB | |
| SCHEMBL16009180 | 0.88 | CA12 (0.64) | CA12CA1CA2CA9THRB | |
| SCHEMBL24996765 | 0.82 | PRKCA (0.46) | CA12CA1CA2CA9THRB | |
| SCHEMBL25716867 | 0.79 | LMNA (0.67) | CA12CA1CA2CA9THRB | |
| SCHEMBL19733727 | 0.79 | LMNA (0.52) | CA12CA1CA2CA9THRB | |
| SCHEMBL4617983 | 0.78 | CA12 (0.52) | CA12CA1CA2CA9CA14 | |
| SCHEMBL4617981 | 0.78 | CA12 (0.52) | CA12CA1CA2CA9CA14 | |
| SCHEMBL8824601 | 0.78 | THRB (0.55) | CA12CA1CA2CA9THRB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1881000-A1 | Conjugates of 2-fluoro-2-deoxy-glucose and their uses as anti cancer agents | INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) | 2008-01-23 | — | — | EP | disclosed |