Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATF1 | P18846 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL29754958 | 1.00 | ATF1 (0.31) | ATF1NFKB1MAPK1 | |
| SCHEMBL29754907 | 0.83 | ATF1 (0.32) | ATF1NFKB1 | |
| SCHEMBL29754896 | 0.81 | TRPV3 (0.31) | MAPK1 | |
| SCHEMBL24676543 | 0.81 | TRPV3 (0.31) | MAPK1 | |
| SCHEMBL29754866 | 0.80 | — | — | |
| SCHEMBL24676975 | 0.80 | — | — | |
| SCHEMBL24676727 | 0.79 | KMT2A (0.30) | — | |
| SCHEMBL24676973 | 0.78 | — | — | |
| SCHEMBL24676738 | 0.77 | CDK2 (0.49) | — | |
| SCHEMBL24676970 | 0.77 | — | — |
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-2022155941-A1 | CDK2 INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2022-07-28 | — | — | WO | disclosed |