Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.63 |
| ▸ | CES1 | P23141 | 4/20 | 0.63 |
| ▸ | MDM2 | Q00987 | 12/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL20237914 | 1.00 | CES2 (0.63) | CES2CES1MDM2KEAP1CA3 | |
| SCHEMBL7806345 | 0.83 | CES2 (0.63) | CES2CES1 | |
| SCHEMBL12909549 | 0.82 | CES2 (0.61) | CES2CES1MDM2KEAP1CA3 | |
| SCHEMBL29798923 | 0.82 | CES2 (0.61) | CES2CES1MDM2KEAP1CA3 | |
| SCHEMBL9516558 | 0.82 | CES2 (0.61) | CES2CES1MDM2KEAP1CA3 | |
| SCHEMBL30485128 | 0.80 | CES2 (0.64) | CES2CES1MDM2KEAP1CA3 | |
| SCHEMBL361431 | 0.80 | DGAT1 (0.47) | CES2CES1 | |
| SCHEMBL13580704 | 0.80 | CES2 (0.64) | CES2CES1MDM2KEAP1CA3 | |
| SCHEMBL21990664 | 0.80 | CES2 (0.64) | CES2CES1MDM2KEAP1CA3 | |
| SCHEMBL2563657 | 0.80 | CES2 (0.64) | CES2CES1MDM2KEAP1CA3 |
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-110325531-B | Benzenesulfonamides and their use as therapeutic agents | 泽农医药公司 | 2022-05-27 | — | — | CN | disclosed |