Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL27982847 | 0.78 | SRC (0.44) | ALDH1A1GAAPOLBHTTLMNA | |
| SCHEMBL27982350 | 0.73 | ALDH1A1 (0.37) | KDM4EALDH1A1L3MBTL1ACHEGAA | |
| SCHEMBL15067995 | 0.72 | ACHE (0.42) | KDM4EALDH1A1L3MBTL1ACHEGAA | |
| SCHEMBL15067275 | 0.72 | ALDH1A1 (0.41) | KDM4EALDH1A1L3MBTL1ACHEGAA | |
| SCHEMBL15067276 | 0.72 | ALDH1A1 (0.41) | KDM4EALDH1A1L3MBTL1ACHEGAA | |
| SCHEMBL15067996 | 0.72 | ACHE (0.42) | KDM4EALDH1A1L3MBTL1ACHEGAA | |
| SCHEMBL15067836 | 0.72 | ALDH1A1 (0.41) | KDM4EALDH1A1L3MBTL1ACHEGAA | |
| SCHEMBL15067834 | 0.72 | ALDH1A1 (0.41) | KDM4EALDH1A1L3MBTL1ACHEGAA | |
| SCHEMBL27827023 | 0.71 | NPSR1 (0.46) | KDM4EALDH1A1GAAPOLBLMNA | |
| SCHEMBL27982836 | 0.68 | PNMT (0.33) | ALDH1A1SMN1; SMN2NFKB1 |
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-104011032-A | Heteroarylpiperidine and piperazine derivatives as fungicides | BAYER IP GMBH | 2014-08-27 | — | — | CN | disclosed |