Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TYR | P14679 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.33 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.31 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL28122704 | 0.79 | HPGD (0.33) | — | |
| SCHEMBL21737534 | 0.78 | ALDH1A1 (0.35) | ALDH1A1SMN1; SMN2CA2POLBTYR | |
| SCHEMBL14817559 | 0.75 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2CA2POLBTYR | |
| SCHEMBL21737619 | 0.74 | MAPT (0.32) | ALDH1A1SMN1; SMN2CA2CYP1A2KDM4E | |
| SCHEMBL21737536 | 0.74 | KDM4E (0.32) | ALDH1A1SMN1; SMN2CA2CYP1A2KDM4E | |
| SCHEMBL26321651 | 0.73 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2CA2POLBTYR | |
| SCHEMBL21719916 | 0.71 | POLB (0.30) | POLB | |
| SCHEMBL21720039 | 0.71 | SMN1; SMN2 (0.34) | ALDH1A1SMN1; SMN2CA2POLBTYR | |
| SCHEMBL21720070 | 0.71 | ALDH1A1 (0.34) | ALDH1A1SMN1; SMN2CA2POLBTYR | |
| SCHEMBL21718722 | 0.71 | ALDH1A1 (0.34) | ALDH1A1SMN1; SMN2CA2POLBTYR |
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 |