Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 10/20 | 0.55 |
| ▸ | CDK7 | P50613 | 2/20 | 0.46 |
| ▸ | CCNH | P51946 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.45 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.45 |
| ▸ | FLT3 | P36888 | 1/20 | 0.45 |
| ▸ | CDK9 | P50750 | 1/20 | 0.45 |
| ▸ | JAK3 | P52333 | 1/20 | 0.45 |
| ▸ | BTK | Q06187 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 3/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 2/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29174703 | 1.00 | EGFR (0.55) | EGFRCDK7CCNHHDAC3HDAC1 | |
| SCHEMBL29174647 | 0.87 | EGFR (0.52) | EGFRCDK7CCNHHDAC3HDAC1 | |
| SCHEMBL29174671 | 0.85 | EGFR (0.47) | EGFRCDK7HDAC3HDAC1RPS6KB1 | |
| SCHEMBL30725427 | 0.85 | EGFR (0.47) | EGFRCDK7HDAC3HDAC1RPS6KB1 | |
| SCHEMBL29174737 | 0.84 | EGFR (0.57) | EGFRCDK7CCNHFLT3JAK3 | |
| SCHEMBL30725442 | 0.83 | CDK7 (0.47) | EGFRCDK7CCNHHDAC3HDAC1 | |
| SCHEMBL29174655 | 0.83 | CDK7 (0.47) | EGFRCDK7CCNHHDAC3HDAC1 | |
| SCHEMBL29174601 | 0.82 | CDK1 (0.59) | EGFRCDK7CCNHHDAC3HDAC1 | |
| SCHEMBL29174734 | 0.82 | HDAC3 (0.51) | CDK7HDAC3HDAC1RPS6KB1FLT3 | |
| SCHEMBL30725437 | 0.82 | HDAC3 (0.51) | CDK7HDAC3HDAC1RPS6KB1FLT3 |
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-117430589-A | 2-aminopyrimidine compound or salt thereof, and preparation method and application thereof | 励缔(杭州)医药科技有限公司 | 2024-01-23 | — | — | CN | disclosed |