Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL68733 | 0.79 | EPHX2 (0.42) | SMYD3 | |
| Hydrochloric Acid SCHEMBL27034982 | 0.77 | EPHX2 (0.41) | SMYD3 | |
| SCHEMBL14115748 | 0.75 | EPHX2 (0.47) | SMYD3 | |
| SCHEMBL31443396 | 0.70 | CHRNA7 (0.32) | — | |
| SCHEMBL932571 | 0.69 | CA1 (0.50) | — | |
| Trifluoroacetic Acid SCHEMBL29191931 | 0.69 | EPHX2 (0.40) | SMYD3 | |
| SCHEMBL24572139 | 0.68 | CHRNA7 (0.33) | — | |
| SCHEMBL23270095 | 0.67 | EPHX2 (0.36) | SMYD3 | |
| SCHEMBL363726 | 0.66 | TP53 (0.48) | — | |
| SCHEMBL1517111 | 0.65 | EPHX2 (0.46) | SMYD3CHRM2CHRM1 |
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-2022258023-A1 | COMPOUND AS CDK KINASE INHIBITOR AND USE THEREOF | 郑州同源康医药有限公司 | 2022-12-15 | — | — | WO | disclosed |