Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.47 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | FBP1 | P09467 | 1/20 | 0.44 |
| ▸ | GPR183 | P32249 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL28760348 | 0.82 | CA12 (0.40) | NFE2L2CA1 | |
| SCHEMBL29259613 | 0.82 | NFE2L2 (0.50) | HSD11B1PTGS1KMT2APKMTNFRSF1A | |
| SCHEMBL28849918 | 0.80 | KMT2A (0.49) | HSD11B1PTGS1KMT2APKMTNFRSF1A | |
| SCHEMBL2298611 | 0.80 | APP (0.52) | HSD11B1PTGS1KMT2APKMNFE2L2 | |
| SCHEMBL2298614 | 0.80 | APP (0.52) | HSD11B1PTGS1KMT2APKMNFE2L2 | |
| SCHEMBL28849917 | 0.80 | KMT2A (0.49) | HSD11B1PTGS1KMT2APKMTNFRSF1A | |
| SCHEMBL1122349 | 0.78 | KMT2A (0.47) | HSD11B1PTGS1KMT2APKMTNFRSF1A | |
| SCHEMBL2128674 | 0.78 | NFE2L2 (0.50) | HSD11B1PTGS1KMT2APKMTNFRSF1A | |
| SCHEMBL1323494 | 0.78 | KMT2A (0.47) | HSD11B1PTGS1KMT2APKMTNFRSF1A | |
| SCHEMBL1122351 | 0.78 | KMT2A (0.47) | HSD11B1PTGS1KMT2APKMTNFRSF1A |
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-114105837-A | Synthesis and application of molecules containing alkenyl sulfonyl | 中国科学院上海有机化学研究所 | 2022-03-01 | — | — | CN | disclosed |