Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 4/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | AGTR2 | P50052 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8140404 | 0.84 | SMN1; SMN2 (0.48) | SMN1; SMN2ALDH1A1TP53KMT2ATSHR | |
| SCHEMBL27920955 | 0.81 | SMN1; SMN2 (0.49) | SMN1; SMN2ALDH1A1TP53KMT2ATSHR | |
| SCHEMBL22462478 | 0.81 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1TP53KMT2ATSHR | |
| SCHEMBL27877159 | 0.80 | TP53 (0.36) | SMN1; SMN2ALDH1A1TP53PDE4APDE4B | |
| SCHEMBL14333359 | 0.78 | SMN1; SMN2 (0.44) | SMN1; SMN2ALDH1A1TP53KMT2ATSHR | |
| SCHEMBL27203361 | 0.74 | RECQL (0.44) | SMN1; SMN2ALDH1A1KMT2ATSHRKDM4E | |
| SCHEMBL27920936 | 0.70 | TP53 (0.39) | SMN1; SMN2ALDH1A1TP53KMT2AMAPT | |
| SCHEMBL27274066 | 0.69 | ARG1 (0.37) | KDM4E | |
| SCHEMBL30467032 | 0.69 | ALDH1A1 (0.31) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL15573050 | 0.69 | SMN1; SMN2 (0.35) | SMN1; SMN2ALDH1A1TSHRKDM4E |
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-110590609-A | Fluorine-containing sulfonyl compound, intermediate, preparation method and application thereof | 中国科学院上海有机化学研究所 | 2019-12-20 | — | — | CN | disclosed |