Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 9/20 | 0.62 |
| ▸ | PGK1 | P00558 | 5/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | G6PD | P11413 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.48 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.48 |
| ▸ | RPS6KB2 | Q9UBS0 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL346704 | 0.81 | NQO2 (0.60) | NQO2PGK1ALDH1A1MAPTNPC1 | |
| SCHEMBL1258372 | 0.79 | NQO2 (0.58) | NQO2PGK1ALDH1A1MAPTPDGFRB | |
| SCHEMBL31530749 | 0.79 | PGK1 (0.68) | NQO2PGK1ALDH1A1MAPTPDGFRB | |
| SCHEMBL1291729 | 0.79 | PGK1 (0.68) | NQO2PGK1ALDH1A1MAPTPDGFRB | |
| SCHEMBL1291852 | 0.79 | PGK1 (0.61) | NQO2PGK1ALDH1A1MAPTPDGFRB | |
| SCHEMBL21497948 | 0.77 | NQO2 (0.61) | NQO2PGK1ALDH1A1MAPTPOLB | |
| SCHEMBL18267360 | 0.77 | NQO2 (0.63) | NQO2PGK1MAPTNPC1LMNA | |
| SCHEMBL9755422 | 0.76 | NQO2 (0.60) | NQO2PGK1ALDH1A1PDGFRBPDGFRA | |
| SCHEMBL25308410 | 0.75 | PDE5A (0.46) | NQO2PGK1ALDH1A1MAPTNPC1 | |
| SCHEMBL29939278 | 0.75 | PDE5A (0.46) | NQO2PGK1ALDH1A1MAPTNPC1 |
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-116143790-A | Functionalized hexaazabenzophenanthryl lithium ion battery positive electrode material, and preparation method and application thereof | 北京化工大学 | 2023-05-23 | — | — | CN | disclosed |