Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K7 | O43318 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.58 |
| ▸ | JAK2 | O60674 | 3/20 | 0.53 |
| ▸ | CDC7 | O00311 | 1/20 | 0.53 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.53 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.53 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.53 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.53 |
| ▸ | PAK4 | O96013 | 1/20 | 0.53 |
| ▸ | PIM1 | P11309 | 1/20 | 0.53 |
| ▸ | PRKACA | P17612 | 1/20 | 0.53 |
| ▸ | CDK2 | P24941 | 1/20 | 0.53 |
| ▸ | SYK | P43405 | 1/20 | 0.53 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.53 |
| ▸ | CLK2 | P49760 | 1/20 | 0.53 |
| ▸ | GSK3A | P49840 | 1/20 | 0.53 |
| ▸ | GSK3B | P49841 | 1/20 | 0.53 |
| ▸ | CDK7 | P50613 | 1/20 | 0.53 |
| ▸ | CDK9 | P50750 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL29250581 | 0.88 | MAPK1 (0.54) | MAP3K7MAPK1MAP2K1JAK2CDC7 | |
| SCHEMBL29499593 | 0.86 | CDK19 (0.57) | MAP3K7MAPK1MAP2K1JAK2CDC7 | |
| SCHEMBL28744905 | 0.86 | CDK19 (0.57) | MAP3K7MAPK1MAP2K1JAK2CDC7 | |
| SCHEMBL28744826 | 0.82 | MAPK1 (0.47) | MAPK1MAP2K1EGFR | |
| SCHEMBL30584592 | 0.79 | ALK (0.56) | MAP3K7MAPK1MAP2K1JAK2CDC7 | |
| SCHEMBL29250568 | 0.79 | ALK (0.56) | MAP3K7MAPK1MAP2K1JAK2CDC7 | |
| SCHEMBL28744869 | 0.77 | MEN1 (0.40) | EGFR | |
| SCHEMBL29250639 | 0.77 | JAK3 (0.47) | MAP3K7MAPK1MAP2K1JAK2CDC7 | |
| SCHEMBL16513511 | 0.76 | MAP3K7 (0.75) | MAP3K7MAPK1MAP2K1JAK2ALK | |
| SCHEMBL24392928 | 0.76 | MAP3K7 (0.53) | MAP3K7MAPK1MAP2K1JAK2CDC7 |
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-114276331-B | 4-aminopiperidine compound and preparation method, pharmaceutical composition and application thereof | 中国药科大学 | 2023-05-23 | — | — | CN | disclosed |
| CN-114276331-A | 4-aminopiperidine compound and preparation method, pharmaceutical composition and application thereof | 中国药科大学 | 2022-04-05 | — | — | CN | disclosed |