Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK2 | Q92630 | 3/20 | 0.65 |
| ▸ | PTP4A3 | O75365 | 1/20 | 0.50 |
| ▸ | CRHBP | P24387 | 1/20 | 0.50 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.50 |
| ▸ | IKBKB | O14920 | 6/20 | 0.47 |
| ▸ | RAF1 | P04049 | 2/20 | 0.47 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | AKT1 | P31749 | 2/20 | 0.47 |
| ▸ | AKT2 | P31751 | 2/20 | 0.47 |
| ▸ | KDR | P35968 | 2/20 | 0.47 |
| ▸ | PRKAG1 | P54619 | 2/20 | 0.47 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.47 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.47 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.47 |
| ▸ | NEK1 | Q96PY6 | 2/20 | 0.47 |
| ▸ | PRKAB1 | Q9Y478 | 2/20 | 0.47 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29929498 | 0.83 | DYRK2 (0.61) | DYRK2PTP4A3CRHBPCRHR2IKBKB | |
| SCHEMBL29929309 | 0.83 | IKBKB (0.61) | DYRK2IKBKBRAF1RPS6KB1MAPK1 | |
| SCHEMBL29928652 | 0.80 | IKBKB (0.61) | DYRK2IKBKBRAF1RPS6KB1MAPK1 | |
| SCHEMBL29929418 | 0.79 | DYRK2 (1.00) | DYRK2IKBKBRAF1RPS6KB1MAPK1 | |
| SCHEMBL13036873 | 0.79 | DYRK2 (1.00) | DYRK2IKBKBRAF1RPS6KB1MAPK1 | |
| SCHEMBL7122621 | 0.79 | DYRK2 (1.00) | DYRK2IKBKBRAF1RPS6KB1MAPK1 | |
| SCHEMBL7122623 | 0.79 | DYRK2 (1.00) | DYRK2IKBKBRAF1RPS6KB1MAPK1 | |
| SCHEMBL13719949 | 0.74 | IKBKB (0.67) | DYRK2IKBKBACHEPTGS2BCHE | |
| SCHEMBL13719950 | 0.74 | IKBKB (0.67) | DYRK2IKBKBACHEPTGS2BCHE | |
| SCHEMBL23095004 | 0.74 | IKBKB (0.56) | DYRK2IKBKBRAF1RPS6KB1MAPK1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115232068-B | Compound and preparation method and application thereof | 北京中医药大学 | 2023-09-08 | — | — | CN | disclosed |
| CN-115232068-B | Compound and preparation method and application thereof | 北京中医药大学 | 2023-09-08 | — | — | CN | disclosed |
| CN-115232068-A | Compound and preparation method and application thereof | 北京中医药大学 | 2022-10-25 | — | — | CN | disclosed |
| CN-115232068-A | Compound and preparation method and application thereof | 北京中医药大学 | 2022-10-25 | — | — | CN | disclosed |