Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.45 |
| ▸ | BAD | Q92934 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MDM2 | Q00987 | 3/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALPG | P10696 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2319435 | 1.00 | CES2 (0.52) | CES2CES1CA1CA2BCL2L1 | |
| SCHEMBL10361690 | 0.82 | CES2 (0.52) | CES2CES1CA1CA2MDM2 | |
| SCHEMBL18585299 | 0.81 | CES2 (0.56) | CES2CES1CA1CA2BCL2L1 | |
| SCHEMBL31191256 | 0.81 | CES2 (0.64) | CES2CES1CA1CA2BCL2L1 | |
| SCHEMBL5151026 | 0.80 | CES2 (0.50) | CES2CES1CA1CA2BCL2L1 | |
| SCHEMBL27607377 | 0.80 | CES2 (0.50) | CES2CES1CA1CA2BCL2L1 | |
| SCHEMBL28075917 | 0.80 | CES2 (0.50) | CES2CES1CA1CA2BCL2L1 | |
| SCHEMBL10580864 | 0.79 | CES2 (0.54) | CES2CES1CA1CA2BCL2L1 | |
| SCHEMBL9193458 | 0.79 | TDP1 (0.52) | CES2CES1CA1CA2NPC1 | |
| SCHEMBL11753976 | 0.78 | CES2 (0.48) | CES2CES1CA1CA2BCL2L1 |
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-117658933-A | 1,2, 4-triazolol substituted benzenesulfonamide derivatives | 贵阳学院 | 2024-03-08 | — | — | CN | disclosed |