Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 3/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.30 |
| ▸ | ADCY5 | O95622 | 4/20 | 0.30 |
| ▸ | STK17B | O94768 | 1/20 | 0.30 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL239530 | 0.84 | LMNA (0.39) | NFKB1NFKB2RELAABCB1ADCY5 | |
| SCHEMBL242414 | 0.78 | LMNA (0.38) | NFKB1NFKB2RELAABCB1ADCY5 | |
| SCHEMBL1401991 | 0.76 | NT5E (0.34) | ABCB1ADCY5 | |
| SCHEMBL241801 | 0.75 | ADORA3 (0.52) | — | |
| SCHEMBL4349797 | 0.74 | ADCY5 (0.40) | ADCY5 | |
| SCHEMBL4349829 | 0.74 | ABCB1 (0.32) | ABCB1ADCY5 | |
| SCHEMBL4353816 | 0.74 | LMNA (0.37) | ABCB1ADCY5 | |
| SCHEMBL4432120 | 0.73 | LMNA (0.37) | ABCB1ADCY5 | |
| SCHEMBL242801 | 0.73 | ADORA1 (0.37) | — | |
| SCHEMBL1401972 | 0.72 | ADORA1 (0.49) | — |
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 |