Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 4/20 | 0.54 |
| ▸ | KIF5B | P33176 | 3/20 | 0.54 |
| ▸ | EGFR | P00533 | 7/20 | 0.52 |
| ▸ | KDR | P35968 | 5/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 5/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.46 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.45 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.45 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.44 |
| ▸ | FLT1 | P17948 | 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 | |
|---|---|---|---|---|
| SCHEMBL28527723 | 1.00 | RET (0.54) | RETKIF5BEGFRKDRHDAC3 | |
| SCHEMBL28516620 | 0.93 | EGFR (0.51) | RETKIF5BEGFRKDRERBB2 | |
| SCHEMBL28522414 | 0.91 | EGFR (0.49) | RETKIF5BEGFRKDRHDAC3 | |
| SCHEMBL28908558 | 0.91 | EGFR (0.49) | RETKIF5BEGFRKDRHDAC3 | |
| SCHEMBL28530529 | 0.89 | EGFR (0.54) | RETKIF5BEGFRKDRHDAC3 | |
| SCHEMBL28522509 | 0.87 | KDR (0.63) | RETKIF5BEGFRKDRHDAC3 | |
| SCHEMBL28521215 | 0.86 | EGFR (0.54) | RETKIF5BEGFRKDRERBB2 | |
| SCHEMBL28535568 | 0.84 | EGFR (0.51) | RETKIF5BEGFRKDRHDAC3 | |
| SCHEMBL28518401 | 0.81 | EGFR (0.53) | EGFRKDRHDAC3HDAC4HDAC1 | |
| SCHEMBL28518388 | 0.81 | RET (0.55) | RETKIF5BEGFRKDRERBB2 |
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-111808031-B | Ferulic acid derivative and preparation method and application thereof | 湖南中医药大学 | 2022-01-14 | — | — | CN | disclosed |
| CN-111808031-A | Ferulic acid derivative and preparation method and application thereof | 湖南中医药大学 | 2020-10-23 | — | — | CN | disclosed |