Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK9 | P50750 | 10/20 | 0.43 |
| ▸ | CDK7 | P50613 | 5/20 | 0.43 |
| ▸ | CDK4 | P11802 | 2/20 | 0.43 |
| ▸ | CDK2 | P24941 | 10/20 | 0.38 |
| ▸ | NOS2 | P35228 | 4/20 | 0.35 |
| ▸ | NOS1 | P29475 | 3/20 | 0.35 |
| ▸ | CCNH | P51946 | 3/20 | 0.35 |
| ▸ | MNAT1 | P51948 | 3/20 | 0.35 |
| ▸ | NOS3 | P29474 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31064055 | 0.88 | ALDH1A1 (0.42) | CDK9CDK7CDK4CDK2 | |
| SCHEMBL31064009 | 0.86 | CDK9 (0.44) | CDK9CDK7CDK4CDK2NOS2 | |
| SCHEMBL31064179 | 0.84 | CDK9 (0.47) | CDK9CDK7CDK4CDK2NOS2 | |
| SCHEMBL31063939 | 0.83 | CDK9 (0.41) | CDK9CDK7CDK4CDK2NOS2 | |
| SCHEMBL31064025 | 0.81 | CDK7 (0.44) | CDK9CDK7CDK4CDK2CCNH | |
| SCHEMBL31064099 | 0.80 | CDK9 (0.49) | CDK9CDK7CDK4CDK2 | |
| SCHEMBL31064140 | 0.79 | CDK7 (0.43) | CDK9CDK7CDK4CDK2CCNH | |
| SCHEMBL31063972 | 0.77 | GPR119 (0.41) | CDK9CDK7CDK4CDK2 | |
| SCHEMBL23547485 | 0.77 | ALDH1A1 (0.52) | CDK9CDK7CDK4CDK2 | |
| SCHEMBL23547517 | 0.76 | CDK9 (0.45) | CDK9CDK7CDK4CDK2 |
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 |