Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13355549 | 1.00 | NOS3 (0.32) | NOS3NOS2NISCH | |
| SCHEMBL10057749 | 1.00 | NOS3 (0.32) | NOS3NOS2NISCH | |
| SCHEMBL13157598 | 0.75 | — | — | |
| SCHEMBL20219274 | 0.75 | — | — | |
| SCHEMBL19360573 | 0.72 | CCR2 (0.33) | NISCH | |
| SCHEMBL28807372 | 0.72 | TAAR1 (0.42) | NOS3NOS2 | |
| SCHEMBL14147152 | 0.71 | GSK3B (0.30) | — | |
| SCHEMBL10111693 | 0.69 | — | — | |
| SCHEMBL28406757 | 0.68 | HTR2B (0.41) | — | |
| SCHEMBL6369641 | 0.65 | NISCH (0.34) | NOS3NOS2NISCH |
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-1966191-B1 | SUBSTITUTED PYRAZINONE DERIVATIVES AS ALPHA2C-ADRENORECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA NV (BE) | 2010-03-17 | — | — | EP | disclosed |