Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29666482 | 1.00 | MEN1 (0.43) | MEN1KMT2AAGTR1BCL2L1ALDH1A1 | |
| SCHEMBL11011223 | 0.76 | SIRT1 (0.48) | ALDH1A1GAAKDM4ERAB9ANPC1 | |
| SCHEMBL27345973 | 0.76 | NPC1 (0.50) | MEN1KMT2AALDH1A1CYP1A2GAA | |
| SCHEMBL6306644 | 0.76 | KDM4E (0.48) | ALDH1A1GAAKDM4ERAB9ANPC1 | |
| SCHEMBL27517395 | 0.74 | NPC1 (0.48) | MEN1KMT2AALDH1A1CYP1A2GAA | |
| SCHEMBL11334883 | 0.72 | SIRT1 (0.74) | MEN1KMT2AAGTR1BCL2L1ALDH1A1 | |
| SCHEMBL3473376 | 0.72 | BCAT2 (0.42) | KMT2AALDH1A1GAAKDM4ERAB9A | |
| SCHEMBL305009 | 0.70 | KDM4E (0.50) | ALDH1A1GAAKDM4ERAB9ANPC1 | |
| SCHEMBL4121945 | 0.70 | KDM4E (0.50) | KMT2AALDH1A1GAAKDM4ERAB9A | |
| SCHEMBL6916759 | 0.70 | CYP2C9 (0.48) | ALDH1A1CYP2C19KDM4ERAB9ANPC1 |
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-112592301-B | Photocatalysis synthesis method of aryl thioether and derivatives thereof | 浙江工业大学 | 2022-06-17 | — | — | CN | disclosed |
| CN-112592301-A | Photocatalysis synthesis method of aryl thioether and derivatives thereof | 浙江工业大学 | 2021-04-02 | — | — | CN | disclosed |