Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGLN1 | Q9GZT9 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TACR1 | P25103 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | BTK | Q06187 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10640944 | 0.77 | KDM4E (0.53) | EGLN1KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL30621188 | 0.75 | GAA (0.65) | EGLN1KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL5624186 | 0.74 | ALDH1A1 (0.54) | EGLN1KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL30969605 | 0.74 | EGLN1 (0.44) | EGLN1KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL2227533 | 0.72 | HDAC3 (0.50) | EGLN1KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL8373325 | 0.72 | MTNR1A (0.52) | KDM4EHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL24851923 | 0.72 | EGLN1 (0.54) | EGLN1KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL8175902 | 0.72 | HDAC3 (0.52) | EGLN1KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL27907002 | 0.71 | HDAC3 (0.52) | EGLN1KDM4EHDAC3HDAC4HDAC1 | |
| SCHEMBL5545969 | 0.71 | KDM4E (0.49) | EGLN1KDM4EHDAC3HDAC4HDAC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117946098-A | Pyrimidine PLK1 inhibitor and preparation method and application thereof | 上海深势唯思科技有限责任公司 | 2024-04-30 | — | — | CN | disclosed |