Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | PRKDC | P78527 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 3/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4649780 | 0.83 | CNR2 (0.37) | CNR2SLC6A4SLC6A2SLC6A3CYP3A4 | |
| SCHEMBL4649692 | 0.82 | CNR2 (0.50) | POLBCNR2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4649737 | 0.81 | CNR2 (0.42) | CDK4CDK2GAAPOLBPIK3CA | |
| SCHEMBL4649712 | 0.81 | CNR2 (0.54) | EGFRPIK3CACNR2SLC6A4SLC6A2 | |
| SCHEMBL4650258 | 0.80 | CNR2 (0.33) | CNR2 | |
| SCHEMBL4649624 | 0.80 | CNR2 (0.42) | CDK4CDK2POLBCNR2CYP1A2 | |
| SCHEMBL4649071 | 0.79 | CNR2 (0.37) | CDK4CNR2CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4649170 | 0.77 | CNR2 (0.55) | EGFRPIK3CACNR2SLC6A4SLC6A2 | |
| SCHEMBL4649775 | 0.76 | CNR2 (0.40) | POLBCNR2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4649631 | 0.76 | CNR2 (0.56) | CDK2EGFRGAAPOLBPIK3CA |
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-1718613-B1 | PYRIDINE DERIVATIVES AND THEIR USE AS CB2 RECEPTOR MODULATORS | GLAXO GROUP LTD (GB) | 2008-09-03 | — | — | EP | disclosed |