Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 8/20 | 0.45 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA3 | P07451 | 3/20 | 0.41 |
| ▸ | CA4 | P22748 | 3/20 | 0.41 |
| ▸ | CA6 | P23280 | 3/20 | 0.41 |
| ▸ | CA5A | P35218 | 3/20 | 0.41 |
| ▸ | CA7 | P43166 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | CA13 | Q8N1Q1 | 3/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28170851 | 0.84 | TLR9 (0.62) | NFE2L2TLR9ALDH1A1CYP3A4MAPK1 | |
| SCHEMBL28432276 | 0.83 | KMT2A (0.44) | NFE2L2TLR9TSHRBRAFALDH1A1 | |
| SCHEMBL28170846 | 0.83 | SIGMAR1 (0.44) | TLR9ALDH1A1CYP3A4MAPK1CA12 | |
| SCHEMBL28170844 | 0.82 | TLR9 (0.53) | NFE2L2TLR9TSHRALDH1A1CNR2 | |
| SCHEMBL28270091 | 0.82 | TLR9 (0.53) | NFE2L2TLR9TSHRALDH1A1CNR2 | |
| SCHEMBL28436993 | 0.81 | NFE2L2 (0.51) | NFE2L2ALDH1A1MAPK1CA1CA2 | |
| SCHEMBL28171487 | 0.81 | NFE2L2 (0.51) | NFE2L2ALDH1A1MAPK1CA1CA2 | |
| SCHEMBL28171486 | 0.80 | ALDH1A1 (0.54) | TLR9TSHRALDH1A1CYP3A4MAPK1 | |
| SCHEMBL28439749 | 0.79 | CA1 (0.45) | TLR9ALDH1A1CA12CA1CA2 | |
| SCHEMBL28170849 | 0.79 | KIF11 (0.40) | NFE2L2TLR9TSHRALDH1A1CYP3A4 |
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-107176915-B | A kind of synthetic method of alkene sulfone compound | 同济大学 | 2019-01-25 | — | — | CN | disclosed |
| CN-107176915-A | A kind of synthetic method of alkene sulfone compound | 同济大学 | 2017-09-19 | — | — | CN | disclosed |