Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ALPL | P05186 | 3/20 | 0.41 |
| ▸ | ALPI | P09923 | 3/20 | 0.41 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.41 |
| ▸ | STS | P08842 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KLK7 | P49862 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL30338389 | 1.00 | MAOB (0.42) | MAOBKDM4EALDH1A1HTTTDP1 | |
| SCHEMBL28849981 | 0.82 | MAOB (0.43) | MAOBHPGDALPLALPISTS | |
| SCHEMBL21456977 | 0.80 | ALDH1A1 (0.67) | KDM4EALDH1A1HTTTDP1HPGD | |
| SCHEMBL21457084 | 0.79 | CCR4 (0.53) | KDM4EALDH1A1HTTTDP1HPGD | |
| SCHEMBL27981344 | 0.78 | HSD17B3 (0.69) | MAOBKDM4EALDH1A1HPGDHSD17B3 | |
| SCHEMBL21457016 | 0.77 | ALDH1A1 (0.54) | KDM4EALDH1A1HTTTDP1HPGD | |
| SCHEMBL21457061 | 0.76 | ALDH1A1 (0.53) | KDM4EALDH1A1HTTTDP1HPGD | |
| SCHEMBL21040130 | 0.70 | ALDH2 (0.37) | KDM4EALDH1A1HPGDMAPK1HSD17B3 | |
| SCHEMBL11584450 | 0.69 | ALDH1A1 (0.67) | KDM4EALDH1A1HTTTDP1HPGD | |
| SCHEMBL28383872 | 0.66 | HSD17B3 (0.73) | MAOBKDM4EALDH1A1HPGDHSD17B3 |
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-114105837-B | Synthesis and application of alkenyl sulfonyl-containing molecules | 中国科学院上海有机化学研究所 | 2023-05-12 | — | — | CN | disclosed |