Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 4/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21742011 | 0.97 | CHRM2 (0.42) | CHRM2CHRM3SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL21742274 | 0.93 | SMN1; SMN2 (0.41) | CHRM2CHRM3SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL21742280 | 0.84 | CHRM2 (0.38) | CHRM2CHRM3SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL21742021 | 0.83 | CHRM2 (0.38) | CHRM2CHRM3SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL21742195 | 0.81 | AHR (0.37) | CHRM2CHRM3SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL21742345 | 0.81 | CHRM2 (0.39) | CHRM2CHRM3SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL21742100 | 0.80 | CHRM2 (0.39) | CHRM2CHRM3SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL21742053 | 0.80 | CHRM2 (0.38) | CHRM2CHRM3SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL21742182 | 0.78 | AHR (0.37) | CHRM2CHRM3SMN1; SMN2L3MBTL1MEN1 | |
| SCHEMBL21742018 | 0.77 | SMN1; SMN2 (0.39) | CHRM2CHRM3SMN1; SMN2L3MBTL1MEN1 |
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-3611164-A1 | PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT | Mitsui Chemicals Agro, Inc. (JP) | 2020-02-19 | — | — | EP | disclosed |