Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 13/20 | 0.59 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.56 |
| ▸ | CDK2 | P24941 | 2/20 | 0.56 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.56 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.51 |
| ▸ | JAK2 | O60674 | 3/20 | 0.50 |
| ▸ | IKBKB | O14920 | 1/20 | 0.50 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.50 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.50 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.50 |
| ▸ | PRKCB | P05771 | 1/20 | 0.50 |
| ▸ | CDK1 | P06493 | 1/20 | 0.50 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.50 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | CDK9 | P50750 | 1/20 | 0.50 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.50 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4349024 | 0.82 | PARP1 (0.50) | CDC7SCN9AJAK2PARP1BRD4 | |
| SCHEMBL29158849 | 0.81 | PDE3B (0.52) | FFAR1 | |
| SCHEMBL2200693 | 0.79 | PARP1 (0.47) | CDC7SCN9AJAK2PARP1BRD4 | |
| SCHEMBL29760700 | 0.75 | PARP1 (0.50) | CDC7CDK2SCN9AIKBKBCCNE1 | |
| SCHEMBL4179418 | 0.74 | CDC7 (1.00) | CDC7CCNA2CDK2CCNA1JAK2 | |
| SCHEMBL27743983 | 0.74 | FFAR1 (0.47) | SCN9AFFAR1 | |
| Urea SCHEMBL27881390 | 0.73 | FFAR4 (0.54) | SCN9APARP1 | |
| SCHEMBL4184711 | 0.72 | CDC7 (1.00) | CDC7CCNA2CDK2CCNA1 | |
| SCHEMBL30608075 | 0.72 | PARP1 (0.56) | SCN9APARP1 | |
| SCHEMBL5143960 | 0.72 | PARP1 (0.56) | SCN9APARP1 |
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-117396465-A | Novel oxazole derivative for preventing or treating allergic diseases and pharmaceutical composition containing the same | 阿斯克里斯有限公司 | 2024-01-12 | — | — | CN | disclosed |