Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.55 |
| ▸ | LTA4H | P09960 | 4/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.54 |
| ▸ | BAX | Q07812 | 1/20 | 0.54 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | PGR | P06401 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.47 |
| ▸ | FEN1 | P39748 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10678296 | 0.98 | LTA4H (0.57) | PARP10LTA4HTSHRNR1H2BAX | |
| SCHEMBL4025301 | 0.98 | MEN1 (0.52) | PARP10LTA4HTSHRNR1H2BAX | |
| Diphenylether SCHEMBL27491160 | 0.95 | LTA4H (0.60) | PARP10LTA4HTSHRNR1H2BAX | |
| Diphenylether SCHEMBL28263293 | 0.93 | LTA4H (0.57) | PARP10LTA4HTSHRNR1H2BAX | |
| Diphenylether SCHEMBL27771097 | 0.91 | LTA4H (0.55) | PARP10LTA4HTSHRNR1H2BAX | |
| SCHEMBL10685198 | 0.88 | LTA4H (0.69) | PARP10LTA4HTSHRNR1H2BAX | |
| SCHEMBL11490982 | 0.87 | PARP10 (0.47) | PARP10LTA4HTSHRNR1H2BAX | |
| SCHEMBL14684351 | 0.86 | KMT2A (0.50) | PARP10LTA4HNR1H2BAXSRD5A2 | |
| Diphenylether SCHEMBL28330457 | 0.85 | LTA4H (0.48) | PARP10LTA4HTSHRNR1H2BAX | |
| Diphenylether SCHEMBL27880927 | 0.85 | PGR (0.49) | PARP10LTA4HTSHRNR1H2BAX |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115677443-B | Method for constructing 1, 4-diketone compound by olefin 1, 2-dicarbonylation | 中国科学院理化技术研究所 | 2024-07-16 | — | — | CN | disclosed |
| CN-115197036-B | Method for performing anti-mahalanobis hydrogen carboxylation reaction on photocatalytic olefin compound and carbon dioxide | 中国科学院理化技术研究所 | 2024-01-23 | — | — | CN | disclosed |
| CN-115677443-A | Method for constructing 1, 4-diketone compound by olefin 1, 2-dicarbonylation | 中国科学院理化技术研究所 | 2023-02-03 | — | — | CN | disclosed |
| CN-115197036-A | Method for carrying out anti-Ma hydrocarboxylation reaction on olefin compound and carbon dioxide by photocatalysis | 中国科学院理化技术研究所 | 2022-10-18 | — | — | CN | disclosed |