Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WEE1 | P30291 | 2/20 | 0.44 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.44 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
| ▸ | EGFR | P00533 | 2/20 | 0.42 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | AXL | P30530 | 1/20 | 0.40 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.40 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | ACP1 | P24666 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | VCP | P55072 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28632697 | 0.87 | NTRK1 (0.45) | WEE1FGFR4PLK1EGFRBRAF | |
| SCHEMBL28652402 | 0.85 | CHEK1 (0.49) | WEE1FGFR4PLK1EGFRBRAF | |
| SCHEMBL28650920 | 0.84 | FGFR4 (0.58) | WEE1FGFR4EGFRBRAFMAPK1 | |
| SCHEMBL28632656 | 0.81 | FGFR4 (0.46) | FGFR4EGFRBRAF | |
| SCHEMBL28645231 | 0.81 | FGFR4 (0.42) | WEE1FGFR4PLK1EGFRBRAF | |
| SCHEMBL28637030 | 0.81 | BRAF (0.43) | FGFR4EGFRBRAFAXLGRIN1 | |
| SCHEMBL28637028 | 0.79 | BRAF (0.45) | WEE1FGFR4PLK1EGFRBRAF | |
| SCHEMBL28637026 | 0.78 | BRAF (0.48) | FGFR4EGFRBRAFAXL | |
| SCHEMBL28645228 | 0.78 | BRAF (0.44) | FGFR4EGFRBRAFNTRK1MAPK1 | |
| SCHEMBL28643660 | 0.76 | FGFR4 (0.39) | WEE1FGFR4EGFRBRAFAXL |
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 |