Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 5/20 | 0.56 |
| ▸ | LTA4H | P09960 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.47 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.45 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.45 |
| ▸ | BAX | Q07812 | 1/20 | 0.45 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.45 |
| ▸ | FEN1 | P39748 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL14257590 | 0.84 | AKR1C3 (0.54) | SRD5A2LTA4HPARP10ERCC5FEN1 | |
| SCHEMBL28543477 | 0.84 | PLAU (0.55) | LTA4HSMN1; SMN2 | |
| SCHEMBL163962 | 0.82 | MAOA (0.50) | TSHR | |
| SCHEMBL22738433 | 0.80 | PARP10 (0.50) | SRD5A2HPGDPARP10TSHRSMN1; SMN2 | |
| SCHEMBL28910971 | 0.79 | SRD5A2 (0.52) | SRD5A2TSHRFFAR1SMN1; SMN2 | |
| SCHEMBL14042627 | 0.79 | FNTA (0.53) | — | |
| SCHEMBL9080731 | 0.78 | SRD5A2 (0.65) | SRD5A2HPGDPARP10NR3C1ERCC5 | |
| SCHEMBL10609924 | 0.77 | MAOB (0.48) | SRD5A2TSHRSMN1; SMN2 | |
| SCHEMBL28551034 | 0.77 | L3MBTL1 (0.47) | SRD5A2HPGDSMN1; SMN2 | |
| SCHEMBL28552018 | 0.77 | L3MBTL1 (0.61) | — |
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-111978216-B | Preparation method of beta-carbonyl sulfone compound | 西南医科大学 | 2023-02-03 | — | — | CN | disclosed |
| CN-111978216-A | Preparation method of beta-carbonyl sulfone compound | 西南医科大学 | 2020-11-24 | — | — | CN | disclosed |