Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.46 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.46 |
| ▸ | RORC | P51449 | 1/20 | 0.46 |
| ▸ | RORB | Q92753 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21040615 | 0.83 | KIF11 (0.52) | MAOBSCN2AALDH1A1TSHRKDM4E | |
| SCHEMBL29669657 | 0.82 | KIF11 (0.46) | ADORA2AADORA1ALDH1A1TSHRKIF11 | |
| SCHEMBL28294522 | 0.82 | KIF11 (0.46) | ADORA2AADORA1ALDH1A1TSHRKIF11 | |
| SCHEMBL28907992 | 0.82 | KIF11 (0.46) | ADORA2AADORA1ALDH1A1TSHRKIF11 | |
| SCHEMBL28667956 | 0.81 | ADORA2A (0.54) | ADORA2AADORA1RORCRORBMAOB | |
| SCHEMBL17840165 | 0.80 | RORC (0.57) | ADORA2AADORA1RORCRORBMAOB | |
| SCHEMBL4004840 | 0.78 | TDP1 (0.50) | ALDH1A1KDM4EHPGD | |
| SCHEMBL29635182 | 0.78 | TDP1 (0.50) | ALDH1A1KDM4EHPGD | |
| SCHEMBL7799500 | 0.77 | TDP1 (0.48) | ALDH1A1KDM4EHPGD | |
| SCHEMBL32685426 | 0.77 | TDP1 (0.48) | ALDH1A1KDM4EHPGD |
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-114478627-B | Allylated monophosphine ligand and preparation method thereof | 湖北大学 | 2023-06-20 | — | — | CN | disclosed |
| CN-114478627-A | Allylation monophosphine ligand and preparation method thereof | 湖北大学 | 2022-05-13 | — | — | CN | disclosed |