Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 8/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15299032 | 0.80 | ALDH1A1 (0.41) | PDK1PDK2PDK3PDK4EPHX1 | |
| SCHEMBL1153020 | 0.80 | PDK1 (0.44) | PDK1PDK2PDK3PDK4EPHX1 | |
| SCHEMBL3393818 | 0.80 | PDK1 (0.48) | PDK1PDK2PDK3PDK4EPHX1 | |
| SCHEMBL183427 | 0.80 | PDK1 (0.44) | PDK1PDK2PDK3PDK4EPHX1 | |
| SCHEMBL261329 | 0.76 | EPHX1 (0.38) | PDK1PDK2PDK3PDK4EPHX1 | |
| SCHEMBL28396739 | 0.74 | EPHX1 (0.42) | PDK1PDK2PDK3PDK4EPHX1 | |
| SCHEMBL28396740 | 0.74 | EPHX1 (0.42) | PDK1PDK2PDK3PDK4EPHX1 | |
| SCHEMBL50080 | 0.74 | ALDH1A1 (0.45) | PDK1PDK2PDK3PDK4EPHX1 | |
| SCHEMBL272103 | 0.74 | ALDH1A1 (0.45) | PDK1PDK2PDK3PDK4EPHX1 | |
| SCHEMBL7778173 | 0.74 | ALDH1A1 (0.45) | PDK1PDK2PDK3PDK4EPHX1 |
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-109718754-A | A kind of vanadium silver nickel metal oxide catalyst, preparation method and applications | 中国石油化工股份有限公司 | 2019-05-07 | — | — | CN | disclosed |