Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK7 | P50613 | 8/20 | 0.37 |
| ▸ | CDK2 | P24941 | 8/20 | 0.37 |
| ▸ | CCNH | P51946 | 5/20 | 0.37 |
| ▸ | MNAT1 | P51948 | 5/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.37 |
| ▸ | CDK1 | P06493 | 3/20 | 0.37 |
| ▸ | CDK9 | P50750 | 6/20 | 0.36 |
| ▸ | CDK4 | P11802 | 3/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 5/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.34 |
| ▸ | CDK8 | P49336 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31064022 | 0.97 | CDK7 (0.38) | CDK7CDK2CCNHMNAT1CCNE1 | |
| SCHEMBL31064529 | 0.91 | CDK7 (0.37) | CDK7CDK2CCNHMNAT1CCNE1 | |
| SCHEMBL31064096 | 0.90 | CDK2 (0.44) | CDK7CDK2CCNHMNAT1CCNE1 | |
| SCHEMBL31064052 | 0.89 | CDK7 (0.38) | CDK7CDK2CCNHMNAT1CCNE1 | |
| SCHEMBL31064132 | 0.83 | CDK7 (0.44) | CDK7CDK2CCNHMNAT1CCNE1 | |
| SCHEMBL31064054 | 0.82 | CDK2 (0.41) | CDK7CDK2CCNHMNAT1CCNE1 | |
| SCHEMBL31064219 | 0.80 | CDK7 (0.44) | CDK7CDK2CCNHMNAT1CCNE1 | |
| SCHEMBL31064139 | 0.78 | CDK7 (0.41) | CDK7CDK2CCNHMNAT1CCNE1 | |
| SCHEMBL31064166 | 0.78 | CDK2 (0.49) | CDK7CDK2CCNHMNAT1CCNE1 | |
| SCHEMBL31064180 | 0.77 | CDK2 (0.43) | CDK7CDK2CCNHMNAT1CCNE1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024175024-A1 | NEW FUSED HETEROCYCLIC COMPOUND AS CDKS INHIBITOR AND USE THEREOF | 杭州德睿智药科技有限公司 | 2024-08-29 | — | — | WO | disclosed |