Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.40 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 2/20 | 0.37 |
| ▸ | LPL | P06858 | 1/20 | 0.37 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.37 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.37 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10300120 | 0.83 | LTA4H (0.55) | LTA4HKCNH2CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL10300217 | 0.81 | LTA4H (0.53) | LTA4HKCNH2CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL6852436 | 0.77 | LTA4H (0.48) | LTA4HKCNH2CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL16473175 | 0.77 | CYP1A1 (0.53) | LTA4HKCNH2CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL338810 | 0.74 | LTA4H (0.70) | LTA4HKCNH2CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL28967308 | 0.74 | APP (0.48) | LTA4HKCNH2CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL13247242 | 0.74 | HDAC2 (0.54) | LTA4HKCNH2CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL154628 | 0.74 | LTA4H (0.53) | LTA4HKCNH2CYP17A1CYP11B1CYP11B2 | |
| SCHEMBL28440897 | 0.74 | CYP1A2 (0.54) | KCNH2CYP3A4MAPTALDH1A1TDP1 | |
| SCHEMBL6854037 | 0.72 | LTA4H (0.44) | LTA4HKCNH2CYP17A1CYP11B1CYP11B2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111423304-B | Synthetic method of 1,1-difluoroolefin compound | 合肥工业大学 | 2023-02-28 | — | — | CN | disclosed |
| CN-111454286-A | Synthetic method of difluoroalkenyl boron compound | 合肥工业大学 | 2020-07-28 | — | — | CN | disclosed |
| CN-111423304-A | Synthesis method of 1, 1-difluoroolefin compound | 合肥工业大学 | 2020-07-17 | — | — | CN | disclosed |