Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.48 |
| ▸ | TGFBR1 | P36897 | 13/20 | 0.44 |
| ▸ | TGFBR2 | P37173 | 6/20 | 0.44 |
| ▸ | PIM1 | P11309 | 2/20 | 0.41 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21765944 | 1.00 | IRAK4 (0.48) | IRAK4TGFBR1TGFBR2PIM1AAK1 | |
| SCHEMBL18654880 | 1.00 | IRAK4 (0.48) | IRAK4TGFBR1TGFBR2PIM1AAK1 | |
| SCHEMBL14881846 | 0.94 | IRAK4 (0.50) | IRAK4TGFBR1TGFBR2PIM1NTRK1 | |
| SCHEMBL14881458 | 0.89 | IRAK4 (0.47) | IRAK4TGFBR1PIM1AAK1NTRK1 | |
| SCHEMBL14881490 | 0.89 | IRAK4 (0.47) | IRAK4TGFBR1PIM1AAK1NTRK1 | |
| SCHEMBL21765966 | 0.88 | IRAK4 (0.46) | IRAK4TGFBR1TGFBR2PIM1AAK1 | |
| SCHEMBL18654582 | 0.84 | IRAK4 (0.48) | IRAK4TGFBR1TGFBR2PIM1NTRK1 | |
| SCHEMBL18654692 | 0.84 | AAK1 (0.49) | IRAK4TGFBR1TGFBR2PIM1AAK1 | |
| SCHEMBL14881882 | 0.83 | IRAK4 (0.49) | IRAK4PIM1NTRK1 | |
| SCHEMBL18654317 | 0.82 | IRAK4 (0.44) | IRAK4TGFBR1PIM1AAK1NTRK1 |
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-2768509-B1 | SUBSTITUTED BICYCLIC AZA-HETEROCYCLES AND ANALOGUES AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2017-03-22 | — | — | EP | disclosed |