Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29565540 | 0.86 | ALDH1A1 (0.44) | ALDH1A1GAAMAP2K1CES1USP2 | |
| SCHEMBL6746228 | 0.71 | MAP2K1 (0.53) | ALDH1A1GAAMAP2K1CES1USP2 | |
| SCHEMBL10366644 | 0.68 | ALDH1A1 (0.51) | ALDH1A1GAAMAP2K1CES1USP2 | |
| SCHEMBL28746513 | 0.68 | SLC6A2 (0.35) | ALDH1A1 | |
| SCHEMBL10860119 | 0.68 | ALDH1A1 (0.53) | ALDH1A1GAAMAP2K1CES1USP2 | |
| SCHEMBL28941315 | 0.68 | ALDH1A1 (0.34) | ALDH1A1 | |
| SCHEMBL13308993 | 0.67 | ALDH1A1 (0.43) | ALDH1A1GAAMAP2K1CES1USP2 | |
| SCHEMBL11472180 | 0.66 | SIGMAR1 (0.54) | ALDH1A1GAAMEN1KMT2ATSHR | |
| SCHEMBL12721306 | 0.66 | CES1 (0.47) | ALDH1A1GAAMAP2K1CES1USP2 | |
| SCHEMBL1585025 | 0.66 | CES1 (0.47) | ALDH1A1GAAMAP2K1CES1USP2 |
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-114539121-A | A novel, photo-promoted process for the preparation of sulfonates and sulfonamides from sulfonyl chlorides | 天津师范大学 | 2022-05-27 | — | — | CN | claimed |