Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL50204 | 0.82 | GAA (0.61) | GAAALDH1A1LMNATSHRHSD17B10 | |
| SCHEMBL21721137 | 0.77 | CYP1A2 (0.36) | GAAALDH1A1LMNAHTTCYP1A2 | |
| SCHEMBL13683148 | 0.74 | GAA (0.44) | GAAALDH1A1LMNATSHRHSD17B10 | |
| SCHEMBL21719783 | 0.68 | LMNA (0.35) | ALDH1A1LMNAHTTCYP1A2CYP2C19 | |
| SCHEMBL18603294 | 0.67 | KDM4E (0.43) | GAAALDH1A1LMNACYP1A2CYP2C19 | |
| SCHEMBL19556424 | 0.67 | KDM4E (0.41) | GAAALDH1A1LMNATSHRHSD17B10 | |
| SCHEMBL15277541 | 0.67 | GAA (0.37) | GAAALDH1A1LMNATSHRHSD17B10 | |
| SCHEMBL21721531 | 0.66 | LMNA (0.33) | ALDH1A1LMNAHTTCYP1A2CYP2C19 | |
| SCHEMBL21721542 | 0.66 | LMNA (0.37) | ALDH1A1LMNAHTTCYP1A2CYP2C19 | |
| SCHEMBL21721176 | 0.66 | ALDH1A1 (0.36) | GAAALDH1A1LMNATSHRHTT |
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-3611165-A1 | PYRIDONE COMPOUND, AND AGRICULTURAL AND HORTICULTURAL FUNGICIDE HAVING THIS AS ACTIVE COMPONENT | Mitsui Chemicals Agro, Inc. (JP) | 2020-02-19 | — | — | EP | disclosed |