Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | MGLL | Q99685 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.48 |
| ▸ | FLT3 | P36888 | 1/20 | 0.48 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | TYR | P14679 | 1/20 | 0.47 |
| ▸ | DAO | P14920 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CDK9 | P50750 | 1/20 | 0.46 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL686830 | 1.00 | KDM4E (0.54) | KDM4ETDP1MGLLHSD17B10CYP2A6 | |
| SCHEMBL6152215 | 0.79 | MAOB (0.43) | KDM4ETDP1MGLLHSD17B10CYP2A6 | |
| SCHEMBL6152213 | 0.79 | HDAC3 (0.41) | KDM4ETDP1MGLLHSD17B10CYP2A6 | |
| Ethoxycarbonyl Group SCHEMBL28518665 | 0.78 | CYP2A6 (0.44) | KDM4ETDP1MGLLHSD17B10CYP2A6 | |
| SCHEMBL103158 | 0.74 | MAOB (0.63) | KDM4ETDP1MGLLHSD17B10CYP2A6 | |
| SCHEMBL30036439 | 0.74 | MAOB (0.63) | KDM4ETDP1MGLLHSD17B10CYP2A6 | |
| SCHEMBL3082095 | 0.73 | MAOB (0.63) | KDM4EHSD17B10HPGDTYRDAO | |
| SCHEMBL2149843 | 0.73 | MAOB (0.61) | KDM4ETDP1HSD17B10HPGDPOLB | |
| SCHEMBL29256707 | 0.71 | KDM4E (0.45) | KDM4ETDP1MGLLHSD17B10CYP2A6 | |
| SCHEMBL11613110 | 0.70 | MAOB (0.68) | KDM4EHPGDSMN1; SMN2CA2MAOB |
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-118812500-A | Substituted aryl diketone nitrile compound with herbicidal activity, preparation method and application | 东北农业大学 | 2024-10-22 | — | — | CN | disclosed |