Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | EDNRA | P25101 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3796970 | 1.00 | KEAP1 (0.50) | KEAP1NFE2L2KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL7896751 | 0.83 | KMT2A (0.47) | KEAP1NFE2L2KMT2AALDH1A1NPSR1 | |
| SCHEMBL1538438 | 0.83 | KMT2A (0.56) | KEAP1NFE2L2KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL330834 | 0.81 | KMT2A (0.46) | KEAP1NFE2L2KMT2AALDH1A1NPSR1 | |
| SCHEMBL27828694 | 0.80 | KEAP1 (0.50) | KEAP1NFE2L2KMT2AALDH1A1NPSR1 | |
| SCHEMBL28278788 | 0.80 | L3MBTL1 (0.50) | L3MBTL1ALDH1A1TSHRKDM4EBCAT2 | |
| SCHEMBL12307 | 0.80 | L3MBTL1 (0.50) | L3MBTL1ALDH1A1TSHRKDM4EBCAT2 | |
| SCHEMBL3780 | 0.79 | MYC (0.46) | KEAP1NFE2L2KMT2AALDH1A1NPSR1 | |
| SCHEMBL401308 | 0.79 | CA2 (0.47) | KEAP1NFE2L2KMT2AALDH1A1TRPA1 | |
| SCHEMBL31310995 | 0.79 | CA2 (0.47) | KEAP1NFE2L2KMT2AALDH1A1TRPA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115385832-A | Preparation method of 2, 3-dimethyl 4-methylsulfonyl bromobenzene | 江苏七洲绿色科技研究院有限公司 | 2022-11-25 | — | — | CN | claimed |
| CN-115385832-A | Preparation method of 2, 3-dimethyl 4-methylsulfonyl bromobenzene | 江苏七洲绿色科技研究院有限公司 | 2022-11-25 | — | — | CN | disclosed |
| CN-112094211-B | Preparation method of topramezone intermediate | 江苏七洲绿色化工股份有限公司 | 2022-04-29 | — | — | CN | disclosed |