Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 16/20 | 0.64 |
| ▸ | CA2 | P00918 | 16/20 | 0.64 |
| ▸ | CA9 | Q16790 | 11/20 | 0.64 |
| ▸ | CA12 | O43570 | 10/20 | 0.64 |
| ▸ | MAPT | P10636 | 2/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL359383 | 0.84 | CA1 (0.73) | CA1CA2CA9CA12MAPT | |
| SCHEMBL1593097 | 0.83 | CA1 (0.64) | CA1CA2CA9CA12MAPT | |
| SCHEMBL4522845 | 0.83 | CA1 (0.64) | CA1CA2CA9CA12MAPT | |
| Hydrochloric Acid SCHEMBL2433442 | 0.81 | CA1 (0.62) | CA1CA2CA9CA12MAPT | |
| SCHEMBL396033 | 0.81 | CA1 (0.61) | CA1CA2CA9CA12MAPT | |
| SCHEMBL27747721 | 0.81 | CA1 (0.76) | CA1CA2CA9CA12MAPT | |
| SCHEMBL7495027 | 0.79 | CA1 (0.69) | CA1CA2CA9CA12MAPT | |
| SCHEMBL2338175 | 0.79 | CA1 (0.63) | CA1CA2CA9CA12MAPT | |
| SCHEMBL9612082 | 0.78 | CA2 (0.62) | CA1CA2CA9CA12MAPT | |
| SCHEMBL1395590 | 0.78 | CA1 (1.00) | CA1CA2CA9CA12MAPT |
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-2013211-B1 | PURINE DERIVATIVES FOR USE AS ADENOSIN A2A RECEPTOR AGONISTS | NOVARTIS AG (CH) | 2012-03-14 | — | — | EP | disclosed |