Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | IKBKB | O14920 | 1/20 | 0.41 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 2/20 | 0.36 |
| ▸ | MMP12 | P39900 | 2/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | USP25 | Q9UHP3 | 5/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | USP28 | Q96RU2 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9542510 | 0.85 | ALDH1A1 (0.47) | ALDH1A1HPGDHSD17B10IKBKBLIMK1 | |
| SCHEMBL16475084 | 0.78 | KDM4E (0.48) | ALDH1A1HPGDHSD17B10IKBKBLIMK1 | |
| SCHEMBL9540890 | 0.71 | ALDH1A1 (0.43) | ALDH1A1HPGDHSD17B10MAPTNPC1 | |
| SCHEMBL16475089 | 0.69 | KDM4E (0.46) | ALDH1A1HPGDHSD17B10MAPTNPC1 | |
| SCHEMBL16479434 | 0.69 | KDM4E (0.46) | ALDH1A1HPGDHSD17B10MAPTNPC1 | |
| SCHEMBL9542497 | 0.68 | ALDH1A1 (0.47) | ALDH1A1HPGDHSD17B10MAPTNPC1 | |
| SCHEMBL9541191 | 0.67 | KMT2A (0.42) | ALDH1A1HPGDHSD17B10MAPTNPC1 | |
| SCHEMBL9541076 | 0.66 | ALDH1A1 (0.47) | ALDH1A1HPGDHSD17B10MAPTNPC1 | |
| SCHEMBL9540994 | 0.65 | ALDH1A1 (0.46) | ALDH1A1HPGDHSD17B10MAPTNPC1 | |
| SCHEMBL9541065 | 0.64 | ALDH1A1 (0.46) | ALDH1A1HPGDHSD17B10IKBKBLIMK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993013664-A2 | BIHETEROCYCLIC FUNGICIDAL COMPOUNDS | SCHERING AGROCHEMICALS LIMITED (GB) | 1993-07-22 | — | — | WO | disclosed |