Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL23904616 | 0.79 | — | — | |
| SCHEMBL13563261 | 0.78 | TSHR (0.35) | — | |
| SCHEMBL13563219 | 0.74 | KDM1A (0.47) | — | |
| SCHEMBL13563221 | 0.72 | DPP4 (0.40) | — | |
| SCHEMBL13563220 | 0.72 | DPP4 (0.41) | — | |
| SCHEMBL13563309 | 0.71 | TSHR (0.40) | — | |
| SCHEMBL19163826 | 0.69 | DRD4 (0.31) | DRD4 | |
| SCHEMBL18015998 | 0.69 | DRD4 (0.31) | DRD4 | |
| SCHEMBL20192288 | 0.67 | — | — | |
| SCHEMBL20192253 | 0.67 | — | — |
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-2016015604-A1 | COMPOUNDS AS CDK SMALL-MOLECULE INHIBITORS AND USES THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-02-04 | — | — | WO | disclosed |