Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.64 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.64 |
| ▸ | EGFR | P00533 | 13/20 | 0.63 |
| ▸ | FLT3 | P36888 | 2/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.58 |
| ▸ | GSK3B | P49841 | 2/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.52 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.51 |
| ▸ | CDK2 | P24941 | 1/20 | 0.51 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.50 |
| ▸ | CDK1 | P06493 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28857003 | 0.90 | MKNK1 (0.60) | MKNK1MKNK2EGFRFLT3HDAC1 | |
| SCHEMBL28856980 | 0.85 | EGFR (0.62) | MKNK1MKNK2EGFRFLT3HDAC1 | |
| SCHEMBL30129576 | 0.85 | EGFR (0.68) | MKNK1MKNK2EGFRFLT3HDAC1 | |
| SCHEMBL30129607 | 0.85 | MKNK1 (0.58) | MKNK1MKNK2EGFRFLT3HDAC1 | |
| SCHEMBL2547336 | 0.85 | EGFR (0.71) | MKNK1MKNK2EGFRFLT3HDAC1 | |
| SCHEMBL30129517 | 0.85 | EGFR (0.68) | MKNK1MKNK2EGFRFLT3HDAC1 | |
| SCHEMBL30129715 | 0.84 | MKNK1 (0.57) | MKNK1MKNK2EGFRFLT3HDAC1 | |
| SCHEMBL28856985 | 0.84 | MKNK1 (0.57) | MKNK1MKNK2EGFRFLT3HDAC1 | |
| SCHEMBL30129265 | 0.84 | MKNK1 (0.56) | MKNK1MKNK2EGFRFLT3HDAC1 | |
| SCHEMBL30129279 | 0.83 | MKNK2 (0.73) | MKNK1MKNK2EGFRFLT3HDAC1 |
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-113563310-B | 4- (1-methylindol-3-yl) pyrimidine derivative and application thereof | 浙江工业大学 | 2022-10-11 | — | — | CN | disclosed |