Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 5/20 | 0.42 |
| ▸ | PPARG | P37231 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | THRA | P10827 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL20607356 | 1.00 | PPARA (0.42) | PPARAPPARGKDM4EALDH1A1GAA | |
| SCHEMBL28743655 | 0.83 | CHRNA1 (0.35) | PPARAKDM4EALDH1A1GAALMNA | |
| SCHEMBL9720564 | 0.78 | ALDH1A1 (0.50) | PPARAPPARGKDM4EALDH1A1GAA | |
| SCHEMBL20607286 | 0.77 | CHRNA1 (0.35) | KDM4EALDH1A1GAATSHRDRD2 | |
| SCHEMBL29628793 | 0.77 | CHRNA1 (0.35) | KDM4EALDH1A1GAATSHRDRD2 | |
| SCHEMBL6321917 | 0.75 | ALDH1A1 (0.36) | PPARGKDM4EALDH1A1GAALMNA | |
| SCHEMBL20607098 | 0.73 | POLB (0.42) | KDM4EALDH1A1 | |
| SCHEMBL6964317 | 0.73 | PREP (0.35) | PPARAPPARGKDM4EALDH1A1GAA | |
| SCHEMBL9127765 | 0.73 | ALDH1A1 (0.41) | PPARAPPARGKDM4EALDH1A1GAA | |
| SCHEMBL6811426 | 0.70 | PPARA (0.50) | PPARAPPARGKDM4EALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-108779076-B | 5-methyl-6-phenyl-4, 5-dihydro-2H-pyridazin-3-one derivatives | 大塚制药株式会社 | 2022-05-03 | — | — | CN | disclosed |