Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD3 | Q9NY59 | 14/20 | 0.54 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK3 | P52333 | 1/20 | 0.41 |
| ▸ | IRAK4 | Q9NWZ3 | 4/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20119620 | 0.86 | SMPD3 (0.48) | SMPD3IRAK4 | |
| SCHEMBL21319492 | 0.85 | SMPD3 (0.47) | SMPD3 | |
| SCHEMBL21319573 | 0.83 | SMPD3 (0.52) | SMPD3PRKDCJAK2JAK3IRAK4 | |
| SCHEMBL21319519 | 0.83 | SMPD3 (0.52) | SMPD3PRKDCJAK2JAK3IRAK4 | |
| SCHEMBL23865295 | 0.82 | SMPD3 (0.51) | SMPD3PRKDCJAK2JAK3IRAK4 | |
| SCHEMBL20119122 | 0.82 | SMPD3 (0.51) | SMPD3PRKDCJAK2JAK3IRAK4 | |
| SCHEMBL20119135 | 0.80 | SMPD3 (0.56) | SMPD3JAK2JAK3 | |
| SCHEMBL19560117 | 0.77 | SMPD3 (0.62) | SMPD3IRAK4 | |
| SCHEMBL21319568 | 0.74 | SMPD3 (0.50) | SMPD3JAK2JAK3IRAK4 | |
| SCHEMBL2069373 | 0.72 | SMPD3 (0.46) | SMPD3PRKDC |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018077246-A1 | AMINO PYRAZOLOPYRIMIDINE COMPOUND USED AS NEUROTROPHIC FACTOR TYROSINE KINASE RECEPTOR INHIBITOR | 正大天晴药业集团股份有限公司 | 2018-05-03 | — | — | WO | disclosed |