Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPE | Q05469 | 3/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 14/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 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 | |
|---|---|---|---|---|
| SCHEMBL22650573 | 0.87 | LIPE (0.35) | LIPEHSD11B1GPR119ROCK2 | |
| SCHEMBL22650572 | 0.77 | CCR5 (0.38) | LIPEGPR119CCR5 | |
| SCHEMBL15244296 | 0.76 | GPR119 (0.42) | HSD11B1GPR119CCR5 | |
| SCHEMBL22650571 | 0.76 | CCR5 (0.39) | LIPEGPR119ROCK2CCR5 | |
| SCHEMBL4339043 | 0.73 | CCR5 (0.45) | GPR119CCR5 | |
| SCHEMBL4349234 | 0.72 | CCR5 (0.44) | HSD11B1GPR119CCR5 | |
| SCHEMBL22650565 | 0.71 | DDB1 (0.38) | — | |
| SCHEMBL24438660 | 0.71 | CA14 (0.34) | HSD11B1CCR5 | |
| SCHEMBL5654759 | 0.70 | DRD2 (0.38) | HSD11B1GPR119 | |
| SCHEMBL13737356 | 0.70 | HSD11B1 (0.46) | HSD11B1GPR119CCR5 |
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-2020224568-A1 | CDK INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2020-11-12 | — | — | WO | disclosed |