Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | SMARCA2 | P51531 | 2/20 | 0.37 |
| ▸ | SMARCA4 | P51532 | 2/20 | 0.37 |
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.37 |
| ▸ | TDO2 | P48775 | 2/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31756613 | 0.81 | MAPK1 (0.41) | ALDH1A1MAPTKDM4ESMARCA2SMARCA4 | |
| SCHEMBL28765461 | 0.80 | NPC1 (0.41) | ALDH1A1MAPTKDM4ELMNANPSR1 | |
| SCHEMBL13276007 | 0.77 | MAPT (0.41) | HSD17B10ALDH1A1MAPTKDM4EHIF1A | |
| SCHEMBL721818 | 0.75 | TDO2 (0.39) | HSD17B10ALDH1A1MAPTKDM4EHIF1A | |
| SCHEMBL28433194 | 0.71 | SQOR (0.41) | HSD17B10ALDH1A1MAPTKDM4EADORA3 | |
| SCHEMBL714013 | 0.71 | ALDH1A1 (0.41) | HSD17B10ALDH1A1MAPTKDM4ETDO2 | |
| SCHEMBL21280056 | 0.71 | HSD17B10 (0.50) | HSD17B10ALDH1A1MAPTKDM4ESMARCA2 | |
| SCHEMBL20080392 | 0.71 | KDM4E (0.41) | HSD17B10ALDH1A1MAPTKDM4EHIF1A | |
| SCHEMBL15672180 | 0.70 | GRM5 (0.31) | ALDH1A1MAPTTOP1CYP1A2CYP2D6 | |
| SCHEMBL904510 | 0.70 | HSD17B10 (0.48) | HSD17B10ALDH1A1MAPTKDM4ESMARCA2 |
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-109879870-B | Synthesis and application of novel functional material based on benzothiadiazole | 常州大学 | 2022-06-28 | — | — | CN | disclosed |