Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRD1 | P41143 | 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 | |
|---|---|---|---|---|
| SCHEMBL17899036 | 0.90 | ROCK1 (0.31) | ROCK1RIPK1PTPN1 | |
| SCHEMBL19089232 | 0.88 | RIPK1 (0.32) | ROCK1RIPK1 | |
| SCHEMBL19088922 | 0.85 | RIPK1 (0.35) | ROCK1RIPK1 | |
| SCHEMBL17898884 | 0.83 | ROCK1 (0.31) | ROCK1RIPK1 | |
| SCHEMBL17898759 | 0.82 | — | — | |
| SCHEMBL19089231 | 0.82 | PDE4D (0.34) | — | |
| SCHEMBL19091284 | 0.82 | RIPK1 (0.33) | RIPK1 | |
| SCHEMBL17899016 | 0.82 | IGF1R (0.32) | RIPK1 | |
| SCHEMBL17898822 | 0.82 | RIPK1 (0.32) | RIPK1 | |
| SCHEMBL19091513 | 0.81 | MERTK (0.34) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016109291-A1 | USE OF MACROCYCLIC PICOLINAMIDES AS FUNGICIDES | DOW AGROSCIENCES LLC (US) | 2016-07-07 | — | — | WO | disclosed |
| WO-2016109290-A1 | MACROCYCLIC PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY | DOW AGROSCIENCES LLC (US) | 2016-07-07 | — | — | WO | disclosed |