Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28640929 | 0.98 | KDM4E (0.59) | ALDH1A1KDM4EMAPK1HSD17B10TSHR | |
| SCHEMBL28641102 | 0.92 | HTT (0.53) | ALDH1A1KDM4EMAPK1HSD17B10HTT | |
| SCHEMBL7619652 | 0.88 | KDM4E (0.48) | ALDH1A1KDM4EMAPK1HSD17B10HTT | |
| SCHEMBL28625836 | 0.88 | SMN1; SMN2 (0.58) | ALDH1A1KDM4EMAPK1HSD17B10HTT | |
| SCHEMBL29274355 | 0.88 | SMN1; SMN2 (0.58) | ALDH1A1KDM4EMAPK1HSD17B10HTT | |
| SCHEMBL29274357 | 0.85 | HRH1 (0.56) | ALDH1A1KDM4EMAPK1HSD17B10HTT | |
| SCHEMBL10816947 | 0.83 | SMN1; SMN2 (0.52) | ALDH1A1KDM4EMAPK1HSD17B10TSHR | |
| SCHEMBL8629697 | 0.81 | HRH1 (0.50) | ALDH1A1MAPK1HTTSMN1; SMN2USP2 | |
| SCHEMBL8973821 | 0.81 | HTT (0.63) | ALDH1A1KDM4EMAPK1HSD17B10HTT | |
| SCHEMBL15386410 | 0.81 | ALDH1A1 (0.62) | ALDH1A1KDM4EMAPK1HSD17B10TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113292509-B | Aromatic thioether compound and preparation method and application thereof | 浙江工业大学 | 2022-09-27 | — | — | CN | disclosed |
| CN-113292509-A | Aromatic thioether compound and preparation method and application thereof | 浙江工业大学 | 2021-08-24 | — | — | CN | disclosed |