Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGL | P06737 | 7/20 | 0.46 |
| ▸ | GPR183 | P32249 | 2/20 | 0.44 |
| ▸ | CCR2 | P41597 | 2/20 | 0.43 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.40 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.40 |
| ▸ | ITGAL | P20701 | 1/20 | 0.40 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2904466 | 1.00 | PYGL (0.46) | PYGLGPR183CCR2ITGB2ICAM1 | |
| SCHEMBL2904453 | 0.97 | PYGL (0.47) | PYGLGPR183CCR2SLC2A1 | |
| SCHEMBL2904455 | 0.97 | PYGL (0.47) | PYGLGPR183CCR2SLC2A1 | |
| SCHEMBL2903668 | 0.93 | GPR183 (0.50) | PYGLGPR183CCR2SLC2A1 | |
| SCHEMBL2903314 | 0.93 | GPR183 (0.50) | PYGLGPR183CCR2SLC2A1 | |
| SCHEMBL2904897 | 0.91 | GPR183 (0.50) | PYGLGPR183CCR2SLC2A1 | |
| SCHEMBL2904898 | 0.91 | GPR183 (0.50) | PYGLGPR183CCR2SLC2A1 | |
| SCHEMBL2899068 | 0.89 | GPR183 (0.52) | PYGLGPR183CCR2SLC2A1 | |
| SCHEMBL2899072 | 0.89 | GPR183 (0.52) | PYGLGPR183CCR2SLC2A1 | |
| SCHEMBL2897821 | 0.89 | PYGL (0.50) | PYGLGPR183CCR2ITGB2ICAM1 |
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-2010506-B1 | DIAZEPAN DERIVATIVES MODULATORS OF CHEMOKINE RECEPTORS | HOFFMANN LA ROCHE (CH) | 2010-08-04 | — | — | EP | disclosed |