Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 1/20 | 0.49 |
| ▸ | CDK8 | P49336 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.46 |
| ▸ | HTR6 | P50406 | 11/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.41 |
| ▸ | CDK2 | P24941 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 4/20 | 0.40 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | HTR7 | P34969 | 3/20 | 0.40 |
| ▸ | MET | P08581 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL30725457 | 1.00 | CCNC (0.49) | CCNCCDK8CYP2C19RPS6KA5HTR6 | |
| SCHEMBL30523959 | 0.90 | L3MBTL1 (0.49) | CCNCCDK8RPS6KA5HTR6PKM | |
| SCHEMBL17490462 | 0.90 | L3MBTL1 (0.49) | CCNCCDK8RPS6KA5HTR6PKM | |
| SCHEMBL31006854 | 0.86 | CCNC (0.44) | CCNCCDK8CYP2C19HTR6PKM | |
| SCHEMBL29429815 | 0.85 | HTR6 (0.56) | HTR6DRD2HTR2AHTR7HTR1A | |
| SCHEMBL6039811 | 0.85 | HTR6 (0.56) | HTR6DRD2HTR2AHTR7HTR1A | |
| SCHEMBL30725479 | 0.82 | CCNC (0.35) | CCNCCDK8CYP2C19RPS6KA5HTR6 | |
| SCHEMBL29174726 | 0.82 | CCNC (0.35) | CCNCCDK8CYP2C19RPS6KA5HTR6 | |
| SCHEMBL1049733 | 0.82 | CYP2C19 (0.48) | CCNCCDK8CYP2C19HTR6PKM | |
| SCHEMBL28862164 | 0.82 | CCNC (0.48) | CCNCCDK8CYP2C19HTR6PKM |
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 |