Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | NAAA | Q02083 | 2/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 3/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | F10 | P00742 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18583407 | 0.92 | GAA (0.38) | GAANAAACCR2BACE1NFKB1 | |
| SCHEMBL17245233 | 0.90 | CHRM2 (0.37) | GAANAAACCR2BACE1F2 | |
| SCHEMBL19084177 | 0.89 | GAA (0.41) | GAANAAABACE1EPHX1NFKB1 | |
| SCHEMBL17898858 | 0.89 | GAA (0.41) | GAANAAABACE1NFKB1NFKB2 | |
| SCHEMBL17426991 | 0.87 | GAA (0.43) | GAANAAABACE1NFKB1NFKB2 | |
| SCHEMBL16605375 | 0.87 | GAA (0.35) | GAANAAACCR2BACE1F2 | |
| SCHEMBL19084159 | 0.86 | NAAA (0.41) | GAANAAA | |
| SCHEMBL16605376 | 0.85 | GAA (0.34) | GAANAAACCR2NFKB1NFKB2 | |
| SCHEMBL16604065 | 0.85 | GAA (0.34) | GAANAAACCR2F2F10 | |
| SCHEMBL19084175 | 0.85 | GAA (0.43) | GAANAAAEPHX1NFKB1NFKB2 |
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-2017116956-A1 | MACROCYCLIC PICOLINAMIDES AS FUNGICIDES | DOW AGROSCIENCES LLC (US) | 2017-07-06 | — | — | WO | disclosed |