Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 17/20 | 0.55 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.54 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.54 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | ROS1 | P08922 | 1/20 | 0.47 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.47 |
| ▸ | FLT4 | P35916 | 1/20 | 0.47 |
| ▸ | FLT3 | P36888 | 1/20 | 0.47 |
| ▸ | IGF1R | P08069 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28639357 | 1.00 | EGFR (0.55) | EGFRMKNK2MKNK1JAK2ROS1 | |
| SCHEMBL28646094 | 1.00 | EGFR (0.55) | EGFRMKNK2MKNK1JAK2ROS1 | |
| SCHEMBL30070701 | 1.00 | EGFR (0.55) | EGFRMKNK2MKNK1JAK2ROS1 | |
| SCHEMBL28925199 | 0.92 | EGFR (0.59) | EGFRMKNK2MKNK1JAK2ROS1 | |
| SCHEMBL30070623 | 0.92 | EGFR (0.59) | EGFRMKNK2MKNK1JAK2ROS1 | |
| SCHEMBL19337082 | 0.89 | EGFR (0.58) | EGFRMKNK2MKNK1JAK2ROS1 | |
| SCHEMBL19336906 | 0.88 | EGFR (0.58) | EGFRMKNK2MKNK1JAK2ROS1 | |
| SCHEMBL14663321 | 0.88 | EGFR (0.70) | EGFRMKNK2MKNK1JAK2ROS1 | |
| SCHEMBL29973838 | 0.88 | EGFR (0.70) | EGFRMKNK2MKNK1JAK2ROS1 | |
| SCHEMBL14719165 | 0.88 | EGFR (0.56) | EGFRMKNK2MKNK1IGF1RMLNR |
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-113354622-B | P-phenylenediamine LSD1 inhibitor and preparation method thereof | 沈阳药科大学 | 2022-11-01 | — | — | CN | disclosed |
| CN-113354622-A | P-phenylenediamine LSD1 inhibitor and preparation method thereof | 沈阳药科大学 | 2021-09-07 | — | — | CN | disclosed |