Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.45 |
| ▸ | CDC25A | P30304 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.42 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 3/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | SLC9A1 | P19634 | 2/20 | 0.39 |
| ▸ | PRKCG | P05129 | 1/20 | 0.39 |
| ▸ | PRKCB | P05771 | 1/20 | 0.39 |
| ▸ | PRKCA | P17252 | 1/20 | 0.39 |
| ▸ | PRKCH | P24723 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28461113 | 0.92 | TDP1 (0.39) | CES1CDC25AKDM4ELMNAALDH1A1 | |
| SCHEMBL29283497 | 0.87 | MEN1 (0.38) | CES1CDC25AKDM4ELMNAALDH1A1 | |
| Bromide SCHEMBL460851 | 0.81 | ALDH1A1 (0.47) | CES1CDC25AKDM4ELMNAALDH1A1 | |
| SCHEMBL459465 | 0.79 | PRKCD (0.45) | CES1CDC25AKDM4ELMNAALDH1A1 | |
| SCHEMBL9722551 | 0.76 | HTR1A (0.44) | CES1CDC25AKDM4ELMNAALDH1A1 | |
| SCHEMBL25387249 | 0.75 | TDP1 (0.40) | CES1CDC25AKDM4ELMNAALDH1A1 | |
| SCHEMBL30141987 | 0.74 | CDC25A (0.61) | CES1CDC25AKDM4ELMNAALDH1A1 | |
| SCHEMBL3635173 | 0.74 | CDC25A (0.61) | CES1CDC25AKDM4ELMNAALDH1A1 | |
| Iodide SCHEMBL5146472 | 0.74 | PDGFRB (0.41) | CES1CDC25AKDM4ELMNAALDH1A1 | |
| SCHEMBL29142651 | 0.74 | CES1 (0.42) | CES1CDC25AKDM4ELMNAALDH1A1 |
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-108360085-B | Polyphenylene sulfide antioxidant fiber based on layered nanoparticles and preparation method thereof | 安徽工程大学 | 2021-02-26 | — | — | CN | disclosed |