Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 15/20 | 0.43 |
| ▸ | NOS3 | P29474 | 2/20 | 0.37 |
| ▸ | NOS1 | P29475 | 2/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | BUB1 | O43683 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL185344 | 0.91 | CCR4 (0.43) | CCR4 | |
| SCHEMBL186084 | 0.82 | CCR4 (0.52) | CCR4 | |
| SCHEMBL186059 | 0.82 | CCR4 (0.51) | CCR4BUB1 | |
| SCHEMBL185657 | 0.82 | CCR4 (0.41) | CCR4 | |
| SCHEMBL185246 | 0.79 | BUB1 (0.42) | CCR4BUB1 | |
| SCHEMBL186309 | 0.78 | CCR4 (0.49) | CCR4 | |
| SCHEMBL186961 | 0.78 | CCR4 (0.44) | CCR4 | |
| SCHEMBL185376 | 0.77 | CCR4 (0.62) | CCR4 | |
| SCHEMBL186057 | 0.74 | CCR4 (0.49) | CCR4 | |
| SCHEMBL355976 | 0.73 | CCR4 (0.82) | CCR4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2401270-A1 | PYRAZOLE DERIVATIVES USED AS CCR4 RECEPTOR ANTAGONISTS | Glaxo Group Limited (GB) | 2012-01-04 | — | — | EP | disclosed |