Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL23198944 | 0.67 | TP53 (0.46) | — | |
| SCHEMBL23197819 | 0.65 | MEN1 (0.33) | SIGMAR1 | |
| SCHEMBL23198668 | 0.64 | NOS3 (0.35) | NOS3NOS1NOS2SIGMAR1 | |
| SCHEMBL23197827 | 0.64 | — | — | |
| SCHEMBL23197732 | 0.61 | NOS3 (0.35) | NOS3NOS1NOS2SIGMAR1 | |
| SCHEMBL23197769 | 0.60 | TP53 (0.49) | — | |
| SCHEMBL23197862 | 0.59 | KDM4E (0.34) | SIGMAR1 | |
| SCHEMBL23197786 | 0.58 | KDR (0.36) | SIGMAR1 | |
| SCHEMBL23197834 | 0.56 | TP53 (0.52) | — | |
| SCHEMBL13624691 | 0.55 | SIGMAR1 (0.49) | SIGMAR1 |
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-2021064077-A1 | SUBSTITUTED PYRAZOLOPYRIMIDINES AS IRAK4 INHIBITORS | BAYER AKTIENGESELLSCHAFT (DE) | 2021-04-08 | — | — | WO | disclosed |